data_1e4t_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 1e4t _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 ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.213 0.53 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.95 -24.42 67.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.93 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -66.55 -43.86 83.94 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.888 . . . . 0.0 110.018 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 38.7 mmt180 -63.31 -35.22 79.65 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.295 -0.878 . . . . 0.0 109.981 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -66.19 -31.02 71.6 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 110.148 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.61 32.75 29.65 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.14 -172.01 48.5 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -117.76 147.69 42.75 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.268 -1.136 . . . . 0.0 110.294 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 16.1 m -99.08 120.24 39.15 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.532 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -116.11 138.19 51.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.126 -0.984 . . . . 0.0 110.402 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.506 ' HG2' ' CE1' ' A' ' 31' ' ' PHE . 74.1 mt-30 -65.52 -27.51 68.52 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.347 -0.846 . . . . 0.0 109.915 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.7 mtm180 -141.33 58.49 1.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.413 -0.805 . . . . 0.0 110.101 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.442 ' C ' ' O ' ' A' ' 16' ' ' ARG . 19.1 t -38.58 124.57 1.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.482 -0.761 . . . . 0.0 110.823 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 72.0 mt -91.59 173.93 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.051 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.426 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -56.88 -48.7 76.59 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.467 ' CD1' ' C ' ' A' ' 20' ' ' LEU . 3.1 tm? -40.81 -40.8 1.43 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.541 -0.976 . . . . 0.0 110.439 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.454 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 93.4 m-85 -88.39 118.71 28.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.43 -0.794 . . . . 0.0 110.497 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.468 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 97.2 m-70 -67.59 150.07 49.26 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.132 -0.98 . . . . 0.0 109.507 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -105.28 125.55 51.11 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.041 -1.037 . . . . 0.0 111.026 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.42 HD11 HG22 ' A' ' 24' ' ' ILE . 10.0 mm -100.76 -37.53 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 CA-C-O 121.737 0.78 . . . . 0.0 109.021 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -171.83 -150.42 7.17 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.325 -1.51 . . . . 0.0 109.325 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.2 p -119.15 160.2 22.55 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -1.219 . . . . 0.0 110.345 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.476 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 86.4 m -87.1 -164.92 1.16 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.219 -0.925 . . . . 0.0 110.627 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -64.92 -42.18 94.91 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.552 -0.718 . . . . 0.0 110.861 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.64 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 66.8 t80 -175.09 140.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -0.924 . . . . 0.0 110.473 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.64 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 38.4 mmt180 57.47 20.68 6.26 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.392 -0.818 . . . . 0.0 110.449 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.506 ' CE1' ' HG2' ' A' ' 15' ' ' GLN . 43.7 m-85 -148.12 152.43 37.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.187 -0.946 . . . . 0.0 110.113 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 27' ' ' CYS . 92.9 mttt -117.81 158.07 25.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.174 -0.954 . . . . 0.0 109.921 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.3 t -94.81 119.34 33.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 87.0 m -136.37 165.12 26.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.387 -0.821 . . . . 0.0 110.063 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -127.83 141.66 51.51 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -106.59 139.14 41.51 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.312 -0.867 . . . . 0.0 110.058 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.273 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.226 0.536 . . . . 0.0 110.45 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.5 t -59.39 -25.78 64.57 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.182 -0.948 . . . . 0.0 109.899 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -63.58 -41.89 98.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.295 -0.878 . . . . 0.0 110.114 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 53.6 mtm180 -75.17 -33.27 61.45 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.318 -0.864 . . . . 0.0 110.261 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.448 ' OE1' HD11 ' A' ' 24' ' ' ILE . 82.1 mt-10 -65.77 -25.78 67.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.317 -0.864 . . . . 0.0 110.116 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.96 12.83 73.3 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.2 165.21 13.01 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.445 ' OE1' ' HA ' ' A' ' 12' ' ' GLU . 68.4 mm-40 -100.92 141.61 33.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.302 -1.117 . . . . 0.0 110.255 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.7 m -100.19 129.87 46.26 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.168 -0.957 . . . . 0.0 110.436 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.2 tp -124.44 166.67 15.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.085 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -79.23 -30.91 43.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.177 -0.952 . . . . 0.0 109.777 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 17' ' ' CYS . 34.0 ttm180 -146.66 76.33 1.43 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.0 109.312 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.437 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.8 t -36.08 126.07 0.75 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.431 0.634 . . . . 0.0 111.057 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.1 pt -95.95 178.82 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.338 -0.851 . . . . 0.0 110.253 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 20' ' ' LEU . . . -56.9 -175.57 0.29 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 19' ' ' GLY . 60.0 mt 61.13 11.42 3.46 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -1.087 . . . . 0.0 110.332 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -135.78 131.0 34.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.0 110.505 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -99.34 142.09 31.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.421 -0.8 . . . . 0.0 109.481 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 84.7 tttt -95.72 112.04 23.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.055 -1.028 . . . . 0.0 111.166 -179.145 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.448 HD11 ' OE1' ' A' ' 9' ' ' GLU . 5.6 mt -87.99 -34.23 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.305 -0.872 . . . . 0.0 108.737 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.76 -156.68 8.33 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.5 p -123.61 156.33 36.0 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.198 -1.178 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.436 ' CB ' ' HB2' ' A' ' 31' ' ' PHE . 83.6 m -74.94 -166.7 0.5 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.375 -0.828 . . . . 0.0 110.427 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.499 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 47.4 t30 -71.64 -35.7 70.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.605 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.57 ' CE2' ' HG3' ' A' ' 30' ' ' ARG . 54.2 t80 179.64 144.96 0.18 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 110.141 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.57 ' HG3' ' CE2' ' A' ' 29' ' ' PHE . 95.3 mtt180 57.18 19.01 4.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.408 -0.807 . . . . 0.0 110.972 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.436 ' HB2' ' CB ' ' A' ' 27' ' ' CYS . 44.1 m-85 -150.48 158.93 44.71 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.899 -1.125 . . . . 0.0 110.655 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.421 ' C ' ' SG ' ' A' ' 27' ' ' CYS . 35.6 mmtp -126.45 159.11 34.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.324 -0.86 . . . . 0.0 109.938 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.401 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 36.4 t -88.22 125.98 34.91 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.194 -0.941 . . . . 0.0 110.166 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 70.1 m -120.28 137.11 54.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 109.928 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.435 ' HD3' HD13 ' A' ' 24' ' ' ILE . 21.9 tptm -121.41 131.51 54.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.117 -0.99 . . . . 0.0 110.374 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.469 ' O ' ' HB3' ' A' ' 37' ' ' GLN . 62.2 t80 -103.45 128.17 50.67 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.469 ' HB3' ' O ' ' A' ' 36' ' ' PHE . 52.5 tt0 . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.271 0.558 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.1 t -63.19 -21.02 65.94 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.231 -0.918 . . . . 0.0 110.062 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -70.48 -37.38 74.24 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.924 . . . . 0.0 109.747 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttp85 -63.75 -37.18 86.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.482 -0.761 . . . . 0.0 109.946 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -69.06 -33.6 73.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.082 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.25 14.87 79.72 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.92 161.83 49.1 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.361 -1.496 . . . . 0.0 109.361 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.525 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 76.3 tt0 -101.97 139.95 36.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -1.202 . . . . 0.0 110.392 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.461 ' O ' HD12 ' A' ' 14' ' ' LEU . 67.6 m -84.71 130.87 34.64 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.36 -0.838 . . . . 0.0 110.13 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.525 ' CD2' ' O ' ' A' ' 12' ' ' GLU . 3.0 mm? -124.54 135.32 53.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 110.3 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.99 -30.65 71.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.239 -0.913 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 17' ' ' CYS . 70.2 mtm180 -139.92 58.97 1.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.372 -0.83 . . . . 0.0 109.761 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.439 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.1 t -40.03 137.91 0.9 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.448 -0.783 . . . . 0.0 110.616 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 46.6 pt -114.14 179.53 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.363 -0.836 . . . . 0.0 110.499 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -54.5 -48.9 62.93 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.425 ' C ' ' O ' ' A' ' 19' ' ' GLY . 15.5 tp -40.69 -41.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.649 -0.912 . . . . 0.0 110.45 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.458 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 90.1 m-85 -98.31 137.07 37.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.437 -0.789 . . . . 0.0 110.155 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -97.88 126.05 43.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.191 -0.943 . . . . 0.0 109.974 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.95 127.3 32.11 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.229 -0.919 . . . . 0.0 110.756 -179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.3 pt -103.44 -13.28 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.345 -0.847 . . . . 0.0 109.745 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.84 -136.78 3.74 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 3.1 m -138.16 157.61 45.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.097 -1.237 . . . . 0.0 110.227 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.451 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 72.8 m -93.7 -161.08 0.81 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.408 -0.808 . . . . 0.0 109.857 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.486 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.9 t30 -41.11 -46.56 3.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.521 -0.737 . . . . 0.0 110.149 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.486 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 92.3 t80 178.95 -63.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.397 -0.814 . . . . 0.0 110.816 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -61.99 -40.81 96.91 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.339 -0.85 . . . . 0.0 111.38 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 27' ' ' CYS . 97.4 m-85 -96.01 164.27 12.78 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.067 -1.021 . . . . 0.0 111.492 -178.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 59.3 mttp -116.4 160.53 20.42 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.657 -0.652 . . . . 0.0 109.318 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 26' ' ' THR . 67.4 m -92.35 121.45 33.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.946 -1.096 . . . . 0.0 110.673 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 68.8 m -127.85 136.81 51.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.442 -0.786 . . . . 0.0 109.865 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -115.49 133.74 55.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.427 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -99.97 141.97 32.08 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.153 179.818 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.245 0.545 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.2 t -60.02 -23.26 63.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.959 . . . . 0.0 109.841 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -65.18 -37.7 88.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -62.53 -37.65 86.92 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.3 -0.875 . . . . 0.0 109.917 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.48 17.96 72.24 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -177.6 43.25 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HG2' HD23 ' A' ' 14' ' ' LEU . 43.8 tt0 -105.86 135.05 48.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.28 -1.13 . . . . 0.0 110.102 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 87.9 m -92.91 130.52 38.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 110.239 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.523 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 3.2 mm? -132.09 143.64 50.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.386 -0.821 . . . . 0.0 110.119 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.539 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 11.2 pt20 -63.2 -33.22 75.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.213 -0.929 . . . . 0.0 109.428 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' A' ' 15' ' ' GLN . 78.8 mtt85 -158.4 61.97 0.44 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.601 -0.687 . . . . 0.0 109.714 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.547 ' O ' ' CG2' ' A' ' 18' ' ' ILE . 22.2 p -60.52 146.88 43.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.19 -0.944 . . . . 0.0 110.494 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.547 ' CG2' ' O ' ' A' ' 17' ' ' CYS . 29.5 pt -158.82 158.25 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.433 -0.792 . . . . 0.0 110.454 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.57 -119.75 4.98 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.6 mt -61.94 -23.16 66.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.31 -1.112 . . . . 0.0 110.554 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -103.73 129.16 51.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.133 -0.98 . . . . 0.0 111.042 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.509 ' HB3' ' NE2' ' A' ' 37' ' ' GLN . 82.7 t60 -119.27 139.44 51.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.387 -0.82 . . . . 0.0 109.174 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -74.27 123.04 23.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.028 -1.045 . . . . 0.0 111.132 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.494 HG13 ' CG ' ' A' ' 35' ' ' LYS . 14.6 mm -93.38 -37.47 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -156.42 -143.49 3.68 Favored Glycine 0 N--CA 1.487 2.059 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.6 p -127.78 164.49 22.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.127 -1.219 . . . . 0.0 110.466 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.7 m -123.31 -176.96 3.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.243 -0.91 . . . . 0.0 110.125 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.512 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 51.6 t-20 -60.03 146.17 43.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 110.157 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.5 t80 70.98 -150.97 0.09 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.305 -0.872 . . . . 0.0 110.417 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -87.71 -5.4 58.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.255 -0.903 . . . . 0.0 110.732 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -72.09 138.9 48.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.183 -0.948 . . . . 0.0 110.234 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 94.2 mttt -103.18 164.93 11.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 13' ' ' CYS . 23.8 m -93.97 134.83 35.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 110.369 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 78.2 m -138.97 134.68 33.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.255 -0.903 . . . . 0.0 109.98 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.494 ' CG ' HG13 ' A' ' 24' ' ' ILE . 98.7 mttt -113.94 143.32 44.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.136 -0.978 . . . . 0.0 110.294 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 138.45 51.68 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 110.15 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.509 ' NE2' ' HB3' ' A' ' 22' ' ' HIS . 68.3 mt-30 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.251 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.473 0.654 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.9 m -54.55 -34.76 62.38 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.389 -0.82 . . . . 0.0 109.646 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -61.08 -42.63 98.86 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.519 -0.738 . . . . 0.0 109.847 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttt-85 -63.69 -35.49 80.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.44 -0.788 . . . . 0.0 110.235 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -71.39 -21.21 62.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 110.252 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.24 19.34 33.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -165.37 40.33 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.462 ' HG3' HD23 ' A' ' 14' ' ' LEU . 39.5 tp10 -135.88 148.49 48.64 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.242 -1.151 . . . . 0.0 110.178 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 67.1 m -111.27 121.04 44.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.229 -0.919 . . . . 0.0 110.374 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.545 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -119.8 150.57 40.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.232 -0.918 . . . . 0.0 110.091 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -62.38 -35.2 78.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 0.0 109.699 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.43 ' O ' HG22 ' A' ' 18' ' ' ILE . 57.6 mtp180 -141.96 58.76 1.48 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.422 -0.799 . . . . 0.0 109.723 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.477 ' O ' HG21 ' A' ' 18' ' ' ILE . 2.0 t -50.73 121.59 6.09 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.333 -0.855 . . . . 0.0 110.57 -179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.477 HG21 ' O ' ' A' ' 17' ' ' CYS . 25.9 pt -140.9 164.92 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.46 -0.775 . . . . 0.0 110.036 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.05 -151.71 17.61 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.5 mt -59.48 -17.99 36.16 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -1.167 . . . . 0.0 110.02 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -68.91 140.49 55.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.402 -0.811 . . . . 0.0 110.91 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.479 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 89.2 m-70 -114.63 162.51 16.68 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.316 -0.865 . . . . 0.0 109.413 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -91.48 111.96 23.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.929 -1.107 . . . . 0.0 110.848 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.433 HD11 HG22 ' A' ' 24' ' ' ILE . 10.4 mm -87.86 -35.19 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.06 -148.79 5.83 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 25.0 p -129.53 152.19 49.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.311 -1.111 . . . . 0.0 110.007 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.542 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 80.1 m -106.14 -174.75 2.61 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.109 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.522 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 93.3 m-20 -99.37 160.88 13.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.292 -0.88 . . . . 0.0 110.428 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.601 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 1.5 t80 71.16 39.03 1.0 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.28 -0.887 . . . . 0.0 110.271 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.507 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 95.5 mtt180 62.52 62.36 1.13 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 110.415 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.601 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 42.3 m-85 -145.68 155.06 42.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.218 -0.926 . . . . 0.0 110.055 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.458 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 48.2 mtmt -113.95 166.95 11.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.15 -0.969 . . . . 0.0 110.338 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.8 t -108.94 128.23 54.75 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 19.5 p -153.08 145.32 23.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.277 -0.889 . . . . 0.0 110.019 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -124.32 156.34 37.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.483 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -79.84 139.88 37.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.356 -0.84 . . . . 0.0 110.02 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.221 -179.802 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.425 0.631 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.2 t -70.76 -28.57 64.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -59.7 -39.53 84.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 85.6 mtt180 -60.55 -42.27 96.21 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.314 -0.866 . . . . 0.0 110.116 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.295 -0.878 . . . . 0.0 110.019 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.38 -3.3 85.36 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.37 174.4 7.86 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 94.4 mt-10 -113.15 137.07 52.0 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.246 -1.15 . . . . 0.0 110.353 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 15.7 m -85.39 124.09 31.59 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.28 -0.888 . . . . 0.0 109.99 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.528 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 3.3 mm? -124.57 146.15 49.2 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.13 -0.981 . . . . 0.0 110.161 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -63.74 -37.06 85.95 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.26 -0.9 . . . . 0.0 109.99 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.457 ' O ' HG22 ' A' ' 18' ' ' ILE . 37.2 ptt180 -137.01 58.12 1.73 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.23 -0.919 . . . . 0.0 109.607 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.527 ' O ' ' CG2' ' A' ' 18' ' ' ILE . 53.8 t -51.73 122.85 8.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.474 -0.766 . . . . 0.0 110.837 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.527 ' CG2' ' O ' ' A' ' 17' ' ' CYS . 19.4 pt -158.32 163.71 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.306 -0.871 . . . . 0.0 110.104 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.02 -145.62 16.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.73 -29.99 71.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.299 -1.118 . . . . 0.0 110.633 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 36' ' ' PHE . 95.5 m-85 -60.83 135.2 57.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.925 . . . . 0.0 110.422 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.432 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 98.0 m-70 -104.76 128.98 53.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.284 -0.885 . . . . 0.0 109.596 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.6 ttpt -81.32 115.76 20.84 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.144 -0.972 . . . . 0.0 110.828 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.452 HD11 HG23 ' A' ' 24' ' ' ILE . 11.1 mt -77.24 -47.4 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 108.868 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -158.79 -168.38 20.82 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -94.08 158.33 15.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.071 -1.252 . . . . 0.0 110.154 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.528 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 57.4 m -85.07 -163.7 0.88 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.207 -0.933 . . . . 0.0 110.668 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.47 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 68.7 m-20 -63.18 -33.01 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 111.197 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.643 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 72.7 t80 -179.62 140.19 0.14 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.022 -1.049 . . . . 0.0 110.878 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.643 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 27.2 mmt85 49.03 25.4 1.09 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.277 -0.889 . . . . 0.0 110.658 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.528 ' CB ' ' HB2' ' A' ' 27' ' ' CYS . 33.6 m-85 -147.45 152.17 37.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.172 -0.955 . . . . 0.0 110.258 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.45 ' O ' ' SG ' ' A' ' 27' ' ' CYS . 52.4 mtmt -115.41 155.31 27.65 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.931 . . . . 0.0 110.181 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 18.0 t -98.91 125.23 44.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.427 -0.795 . . . . 0.0 110.327 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.2 m -132.63 163.88 27.93 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.279 -0.888 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -131.93 140.56 49.06 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.365 -0.834 . . . . 0.0 109.97 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.54 ' HB3' ' CE1' ' A' ' 21' ' ' PHE . 44.6 p90 -123.64 161.43 25.06 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 110.256 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.409 -179.911 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.318 0.58 . . . . 0.0 109.92 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.81 -25.57 68.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.391 -0.818 . . . . 0.0 110.194 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -64.24 -38.93 92.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.357 -0.84 . . . . 0.0 110.078 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -57.82 -34.71 69.95 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.2 -0.937 . . . . 0.0 110.037 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -58.75 -29.23 66.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.235 -0.916 . . . . 0.0 110.109 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.85 10.76 34.2 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.54 -176.81 16.16 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 49.2 tp10 -110.01 130.28 55.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.258 -1.143 . . . . 0.0 109.952 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 96.7 m -106.32 134.0 50.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.304 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.575 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 3.4 mm? -120.75 151.4 39.61 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.361 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -67.85 -24.91 65.31 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.373 -0.829 . . . . 0.0 109.619 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.451 ' O ' ' C ' ' A' ' 17' ' ' CYS . 81.3 mtm180 -145.71 59.23 1.26 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.454 -0.779 . . . . 0.0 109.897 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.451 ' C ' ' O ' ' A' ' 16' ' ' ARG . 38.4 t -36.24 122.08 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.572 -0.705 . . . . 0.0 110.555 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.6 mt -77.13 170.77 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.398 -0.814 . . . . 0.0 110.152 -179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -58.93 -49.36 79.12 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.284 -1.527 . . . . 0.0 109.284 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' GLY . 16.6 tp -42.96 -40.05 2.84 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.439 -1.036 . . . . 0.0 110.231 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.437 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 68.9 m-85 -82.33 140.27 33.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.353 -0.842 . . . . 0.0 110.219 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.424 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 68.2 m80 -97.62 139.1 34.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.334 -0.854 . . . . 0.0 109.707 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 64.4 tttt -94.58 119.34 33.1 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.078 -1.014 . . . . 0.0 110.566 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.525 HD13 ' CD ' ' A' ' 35' ' ' LYS . 9.5 mt -90.59 -38.98 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 108.921 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -163.46 -163.72 16.9 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.2 m -104.5 168.24 9.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.084 -1.245 . . . . 0.0 110.259 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.541 ' N ' ' O ' ' A' ' 31' ' ' PHE . 59.7 m -119.18 -171.67 2.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.38 -0.825 . . . . 0.0 109.824 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 55.1 t30 -93.77 153.65 18.19 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.192 -0.942 . . . . 0.0 110.469 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 1.8 t80 72.2 36.64 1.06 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.34 -0.85 . . . . 0.0 110.499 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 99.7 mtt180 60.27 52.11 5.1 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.356 -0.84 . . . . 0.0 111.055 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' CYS . 25.0 m-85 -125.74 140.99 52.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.199 -0.938 . . . . 0.0 109.831 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.494 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 34.2 mmtp -87.9 156.79 19.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.065 -1.022 . . . . 0.0 109.597 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 27.6 t -102.63 123.2 45.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.229 -0.919 . . . . 0.0 109.866 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 50.6 m -141.63 154.17 45.21 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.149 -0.97 . . . . 0.0 110.577 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.525 ' CD ' HD13 ' A' ' 24' ' ' ILE . 53.1 mtpt -134.89 159.35 41.69 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.968 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -112.04 126.1 54.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.09 -1.006 . . . . 0.0 110.377 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.313 179.907 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.237 0.541 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.7 m -57.96 -24.25 57.2 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.397 -0.814 . . . . 0.0 109.762 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -60.96 -36.76 80.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 109.781 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -67.64 -40.22 84.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.361 -0.837 . . . . 0.0 109.889 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -65.73 -25.71 67.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.292 -0.88 . . . . 0.0 110.048 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.89 1.58 57.28 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.801 -1.319 . . . . 0.0 109.801 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.98 -172.01 7.62 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -130.54 143.91 51.06 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.199 -1.177 . . . . 0.0 110.256 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 30.1 m -105.21 122.88 46.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.388 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.589 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.8 mm? -122.98 144.8 49.01 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.37 -0.831 . . . . 0.0 110.1 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -57.54 -19.27 24.02 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.171 -0.955 . . . . 0.0 110.011 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' A' ' 17' ' ' CYS . 32.5 ttm180 -168.62 72.96 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.359 -0.838 . . . . 0.0 109.863 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.434 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 61.2 m -40.03 147.91 0.09 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.513 -0.742 . . . . 0.0 110.54 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.428 HG22 HD11 ' A' ' 18' ' ' ILE . 63.0 mt -84.47 173.84 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.344 -0.847 . . . . 0.0 109.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -53.73 -46.36 67.32 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.489 ' C ' ' CD1' ' A' ' 20' ' ' LEU . 3.4 tm? -51.12 -44.79 61.41 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.483 ' CE2' ' CD1' ' A' ' 36' ' ' PHE . 94.6 m-85 -76.39 149.52 36.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.889 . . . . 0.0 110.829 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.438 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.9 m-70 -114.25 143.56 44.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.357 -0.839 . . . . 0.0 109.665 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 39.8 ttpt -99.36 121.6 41.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.131 -0.98 . . . . 0.0 110.75 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.492 HG22 HD11 ' A' ' 24' ' ' ILE . 6.0 mt -85.77 -33.51 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.321 -0.862 . . . . 0.0 108.941 179.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -167.5 -131.91 1.34 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 108.907 -1.677 . . . . 0.0 108.907 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.5 m -130.19 163.41 26.73 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.134 -1.215 . . . . 0.0 110.207 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.502 ' CB ' ' O ' ' A' ' 31' ' ' PHE . 1.1 t -94.87 -156.61 0.52 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 0.0 110.488 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 78.8 m-20 -64.99 56.84 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.762 -0.586 . . . . 0.0 111.021 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 88.3 t80 53.0 17.11 0.83 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.183 -0.948 . . . . 0.0 110.911 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 28' ' ' ASN . 97.1 mtt180 -125.87 -40.79 2.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.886 -1.133 . . . . 0.0 110.366 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.502 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 99.1 m-85 -128.16 170.05 13.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.224 -0.923 . . . . 0.0 110.077 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 74.6 mmtt -87.62 157.16 19.19 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.893 . . . . 0.0 109.927 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.8 t -94.35 110.77 22.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.305 -0.872 . . . . 0.0 109.954 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 99.3 m -129.42 163.95 24.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.38 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -131.53 132.31 44.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.352 -0.843 . . . . 0.0 110.016 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.483 ' CD1' ' CE2' ' A' ' 21' ' ' PHE . 61.1 t80 -107.26 123.64 48.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.142 -0.974 . . . . 0.0 110.264 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 117.945 -1.026 . . . . 0.0 110.25 -179.863 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.203 0.525 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.6 t -60.53 -26.24 66.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.348 -0.845 . . . . 0.0 110.076 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -65.46 -35.68 81.64 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.297 -0.877 . . . . 0.0 110.162 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.1 mmm180 -99.7 -56.06 2.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.957 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -80.97 -26.56 36.49 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.299 -0.876 . . . . 0.0 109.969 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.468 ' CA ' ' O ' ' A' ' 6' ' ' CYS . . . -89.41 9.07 78.37 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.46 ' HA2' ' O ' ' A' ' 34' ' ' CYS . . . 57.62 -117.2 9.42 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.48 ' HG3' ' CE1' ' A' ' 36' ' ' PHE . 95.5 mt-10 -120.07 145.28 47.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.257 -1.143 . . . . 0.0 110.317 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 85.4 m -93.99 125.44 38.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.272 -0.892 . . . . 0.0 109.673 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 tp -128.47 164.86 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.489 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.577 ' CG ' ' CE1' ' A' ' 31' ' ' PHE . 90.9 mt-30 -73.75 -42.4 61.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.331 -0.855 . . . . 0.0 109.756 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.2 mtt-85 -122.37 63.14 0.95 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.36 -0.837 . . . . 0.0 109.48 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.469 ' C ' ' O ' ' A' ' 16' ' ' ARG . 45.3 t -34.54 118.45 0.4 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.395 0.617 . . . . 0.0 111.137 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.554 HD12 ' CG ' ' A' ' 21' ' ' PHE . 37.9 pt -59.25 168.64 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.325 -0.859 . . . . 0.0 109.999 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -77.2 -50.46 6.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.448 ' HB3' HD13 ' A' ' 18' ' ' ILE . 48.5 tp -40.91 -32.64 0.24 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.544 -0.974 . . . . 0.0 110.565 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.584 ' CZ ' ' HB2' ' A' ' 36' ' ' PHE . 7.0 m-30 -91.99 115.48 28.11 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.405 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 62.6 t-80 -66.22 139.86 58.12 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.322 -0.861 . . . . 0.0 110.285 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 33' ' ' CYS . 39.5 ttpt -101.24 107.66 19.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.225 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.509 HG13 ' N ' ' A' ' 25' ' ' GLY . 32.3 pt -70.56 -27.48 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.27 -0.894 . . . . 0.0 109.965 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.509 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 177.7 -135.48 2.74 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.462 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -127.77 166.15 18.73 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.198 -1.178 . . . . 0.0 110.441 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 74.4 m -100.63 -176.96 3.34 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.655 -0.653 . . . . 0.0 109.684 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.3 t30 -80.67 52.04 1.61 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.009 -1.057 . . . . 0.0 109.52 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.489 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 79.5 t80 -179.91 176.91 0.71 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.691 -0.63 . . . . 0.0 109.893 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.433 ' N ' ' CG ' ' A' ' 29' ' ' PHE . 91.1 mmt-85 -53.59 -16.83 1.73 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.13 -0.981 . . . . 0.0 110.887 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 15' ' ' GLN . 7.1 m-30 -76.64 167.13 22.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.025 -1.047 . . . . 0.0 110.357 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.484 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 43.3 mmtm -120.32 161.37 21.26 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 110.195 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 83.1 m -86.35 133.66 33.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.138 -0.976 . . . . 0.0 110.409 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.46 ' O ' ' HA2' ' A' ' 11' ' ' GLY . 62.6 m -141.36 147.17 37.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.895 . . . . 0.0 110.305 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -107.93 127.86 54.12 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.348 -0.845 . . . . 0.0 110.287 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.584 ' HB2' ' CZ ' ' A' ' 21' ' ' PHE . 41.0 p90 -126.48 162.75 24.89 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.159 -0.963 . . . . 0.0 110.128 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.163 179.842 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.293 0.568 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 t -61.0 -24.98 66.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.184 -0.947 . . . . 0.0 109.716 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -70.15 -29.37 66.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.399 -0.813 . . . . 0.0 109.711 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -67.79 -33.45 74.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.3 -0.875 . . . . 0.0 110.166 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.447 ' OE2' HG12 ' A' ' 24' ' ' ILE . 52.7 mt-10 -59.94 -26.58 66.08 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.263 -0.898 . . . . 0.0 110.269 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.76 -12.52 68.54 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.27 179.87 53.34 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.524 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 79.6 mm-40 -122.36 147.03 46.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.225 -1.162 . . . . 0.0 110.085 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 74.9 m -86.16 124.22 32.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.21 -0.931 . . . . 0.0 110.106 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.551 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 3.1 mm? -110.94 139.34 46.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.553 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.529 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 29.3 pt20 -65.28 -26.55 68.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.324 -0.86 . . . . 0.0 109.894 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' CYS . 76.3 mtm-85 -140.86 55.82 1.57 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.414 -0.804 . . . . 0.0 109.66 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' ARG . 15.9 t -38.69 143.86 0.13 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.574 -0.704 . . . . 0.0 110.589 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.447 HD12 HG22 ' A' ' 18' ' ' ILE . 40.4 pt -120.86 175.74 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.321 -0.862 . . . . 0.0 110.137 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -55.48 -48.13 72.1 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 94.9 mt -44.14 -37.55 3.18 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.445 -1.032 . . . . 0.0 110.223 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -99.16 116.7 31.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.385 -0.822 . . . . 0.0 110.443 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -71.55 136.71 47.59 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.942 . . . . 0.0 109.568 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.522 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 86.3 tttt -86.56 100.9 12.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.069 -1.02 . . . . 0.0 110.487 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.449 HG22 ' N ' ' A' ' 25' ' ' GLY . 13.8 tt -63.03 -41.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.347 -0.846 . . . . 0.0 109.835 179.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.522 ' O ' ' CE ' ' A' ' 23' ' ' LYS . . . -158.63 -132.49 1.4 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.483 HG21 ' CE ' ' A' ' 23' ' ' LYS . 38.9 p -138.77 138.61 37.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -1.156 . . . . 0.0 110.047 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 31' ' ' PHE . 1.4 t -98.1 -159.64 0.75 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.167 -0.958 . . . . 0.0 109.64 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.525 ' OD1' ' N ' ' A' ' 31' ' ' PHE . 22.1 p30 -51.94 164.17 0.29 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.512 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -59.35 -12.62 6.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.98 -1.075 . . . . 0.0 111.346 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.583 ' HG3' ' CE1' ' A' ' 31' ' ' PHE . 46.7 tpt85 -98.78 -10.28 23.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.869 -1.144 . . . . 0.0 110.693 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.583 ' CE1' ' HG3' ' A' ' 30' ' ' ARG . 87.7 m-85 -144.38 154.63 43.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.959 -1.088 . . . . 0.0 110.647 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.49 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 87.3 mttt -106.91 155.22 19.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.428 ' HB2' ' C ' ' A' ' 25' ' ' GLY . 27.1 m -89.09 122.94 32.9 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.111 -0.993 . . . . 0.0 110.852 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 96.7 m -141.59 161.94 36.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.34 -0.85 . . . . 0.0 110.157 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -140.94 157.09 45.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.242 -0.911 . . . . 0.0 110.231 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.7 t80 -108.71 135.56 49.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.217 -0.927 . . . . 0.0 110.091 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.451 ' HG3' ' OXT' ' A' ' 37' ' ' GLN . 8.2 tp60 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.069 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.296 0.57 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.0 t -57.49 -20.92 34.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.918 . . . . 0.0 110.139 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -69.92 -42.68 72.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.841 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -63.77 -34.24 77.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.374 -0.829 . . . . 0.0 109.944 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.415 ' OE1' ' SG ' ' A' ' 33' ' ' CYS . 97.7 mt-10 -64.37 -36.24 83.5 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.359 -0.838 . . . . 0.0 110.322 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.89 -4.58 28.96 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.21 -173.0 49.58 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -123.78 150.98 43.81 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.224 -1.162 . . . . 0.0 110.24 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 25.7 m -92.78 116.17 28.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.207 -0.933 . . . . 0.0 110.311 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.55 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 3.2 mm? -121.37 132.89 55.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.209 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -53.54 -32.72 51.87 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.159 -0.963 . . . . 0.0 109.844 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 -150.89 64.72 0.92 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.348 -0.845 . . . . 0.0 110.25 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.472 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 19.3 p -55.16 168.77 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 110.402 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.523 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 41.4 pt -95.45 159.74 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.45 -0.781 . . . . 0.0 110.272 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.461 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -52.73 -45.87 60.13 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.523 ' HB2' ' CD1' ' A' ' 18' ' ' ILE . 9.9 mp -37.48 -36.02 0.15 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.858 -0.79 . . . . 0.0 110.451 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 8.7 m-30 -88.54 116.05 26.5 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.438 -0.789 . . . . 0.0 110.108 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.483 ' N ' ' O ' ' A' ' 35' ' ' LYS . 60.2 t-80 -68.64 141.95 55.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.046 -1.034 . . . . 0.0 109.95 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.2 ttmt -90.93 114.44 26.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.096 -1.002 . . . . 0.0 110.176 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.9 mt -78.15 -43.37 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.273 -0.892 . . . . 0.0 108.598 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.41 ' C ' HG21 ' A' ' 26' ' ' THR . . . -163.69 -141.7 3.2 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.41 HG21 ' C ' ' A' ' 25' ' ' GLY . 43.0 p -131.18 154.83 47.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.249 -1.148 . . . . 0.0 110.361 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 64.8 m -83.88 -166.84 1.52 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.25 -0.906 . . . . 0.0 110.238 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 59.3 t30 -39.69 -49.51 2.26 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.529 -0.732 . . . . 0.0 110.736 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 89.6 t80 -178.83 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 111.025 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -66.48 -43.25 85.96 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.186 -0.946 . . . . 0.0 111.383 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 27' ' ' CYS . 93.3 m-85 -90.05 162.57 15.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.994 -1.067 . . . . 0.0 111.068 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.461 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 46.5 mttm -117.38 165.06 13.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.461 -0.774 . . . . 0.0 109.522 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 13.8 t -99.17 113.15 25.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.992 -1.068 . . . . 0.0 110.473 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.5 m -130.76 131.88 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.358 -0.839 . . . . 0.0 109.774 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 22' ' ' HIS . 80.9 tttt -134.98 155.66 50.38 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.233 -0.917 . . . . 0.0 110.573 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -95.14 137.11 34.63 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.332 -0.855 . . . . 0.0 110.068 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.291 179.931 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.149 0.5 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.1 t -60.99 -16.73 46.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -76.92 -40.08 48.47 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.221 -0.924 . . . . 0.0 109.717 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -60.25 -38.75 84.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.416 -0.803 . . . . 0.0 110.017 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.18 -37.12 84.84 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.273 -0.892 . . . . 0.0 110.079 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.08 21.1 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -86.16 -169.67 46.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -126.57 148.02 49.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.329 -1.101 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 97.0 m -102.22 121.96 43.26 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.561 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 3.0 mm? -110.67 147.08 35.07 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.23 -0.918 . . . . 0.0 110.54 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.589 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 27.9 pt20 -75.07 -25.6 58.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -0.897 . . . . 0.0 109.936 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 17' ' ' CYS . 99.3 mtt180 -147.14 64.75 1.16 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.4 -0.812 . . . . 0.0 110.19 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.478 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 73.7 m -38.13 157.28 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.388 -0.82 . . . . 0.0 110.898 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.5 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 43.7 pt -127.38 172.67 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.393 -0.817 . . . . 0.0 109.943 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -46.84 -46.51 19.2 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.538 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 3.8 mm? -49.68 -36.23 24.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.518 -0.99 . . . . 0.0 110.703 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 53.2 m-85 -111.37 140.93 45.54 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.059 -179.122 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -112.93 134.25 54.53 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.33 -0.857 . . . . 0.0 109.353 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 34.9 ttpt -67.27 123.1 19.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.199 -0.938 . . . . 0.0 111.433 -178.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.2 mm -90.65 -35.38 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.417 ' C ' ' HB3' ' A' ' 33' ' ' CYS . . . -152.42 -133.17 1.9 Allowed Glycine 0 N--CA 1.486 1.997 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.5 m -134.28 166.53 22.6 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.163 -1.198 . . . . 0.0 111.031 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 33' ' ' CYS . 91.2 m -143.29 -164.17 1.8 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.651 -0.656 . . . . 0.0 109.411 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.45 ' C ' ' O ' ' A' ' 27' ' ' CYS . 20.7 t-20 -40.53 155.45 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.804 . . . . 0.0 109.961 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -49.97 -35.48 24.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.16 -0.962 . . . . 0.0 111.017 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.41 ' NH1' ' OD1' ' A' ' 28' ' ' ASN . 91.8 mtm-85 -94.46 6.68 48.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.958 -1.089 . . . . 0.0 110.68 -179.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.589 ' CE1' ' HB3' ' A' ' 15' ' ' GLN . 95.9 m-85 -139.0 155.0 48.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.179 -0.951 . . . . 0.0 110.442 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.494 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 63.2 mttp -129.01 156.66 43.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.99 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.498 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 50.5 t -79.34 119.19 22.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.312 -0.868 . . . . 0.0 110.353 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 23' ' ' LYS . 32.9 m -139.31 133.07 30.69 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 110.215 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -124.29 155.02 39.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.177 -0.952 . . . . 0.0 110.156 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -80.85 139.52 35.91 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.346 -0.846 . . . . 0.0 110.108 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 117.936 -1.031 . . . . 0.0 110.233 -179.943 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.636 ' CB ' ' CE1' ' A' ' 7' ' ' TYR . . . . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.277 0.56 . . . . 0.0 110.137 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -76.42 -16.6 59.66 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.199 -0.938 . . . . 0.0 110.067 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.636 ' CE1' ' CB ' ' A' ' 5' ' ' ALA . 50.9 p90 -80.23 -46.53 16.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 0.0 109.895 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.629 ' CG ' ' CE2' ' A' ' 7' ' ' TYR . 57.4 mtt180 -49.78 -36.52 26.37 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.59 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -60.68 -37.84 82.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.424 -0.797 . . . . 0.0 109.927 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.94 4.46 55.53 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -82.69 -158.82 25.28 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.511 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 85.4 tt0 -143.41 135.29 26.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -1.171 . . . . 0.0 110.211 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.484 ' C ' ' CD2' ' A' ' 14' ' ' LEU . 89.2 m -83.1 136.26 34.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.159 -0.963 . . . . 0.0 110.119 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.514 ' N ' HD21 ' A' ' 14' ' ' LEU . 3.3 mm? -127.87 134.69 49.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.146 -0.971 . . . . 0.0 110.358 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.534 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 15.2 pt20 -59.98 -24.63 64.6 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.338 -0.851 . . . . 0.0 110.353 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.427 ' O ' ' C ' ' A' ' 17' ' ' CYS . 89.2 mmt-85 -142.65 50.58 1.46 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 109.981 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.427 ' C ' ' O ' ' A' ' 16' ' ' ARG . 12.6 t -42.15 138.85 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.367 -0.833 . . . . 0.0 110.387 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.9 pt -108.62 176.78 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 110.077 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -53.47 -49.1 58.46 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 19' ' ' GLY . 15.7 tp -41.36 -29.87 0.16 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.505 -0.997 . . . . 0.0 110.425 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.96 113.75 26.73 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.279 -0.888 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.478 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 93.0 m-70 -67.83 148.45 51.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.237 -0.914 . . . . 0.0 109.521 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 37.0 ttpt -110.6 111.79 23.24 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.173 -0.954 . . . . 0.0 110.786 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.454 HG23 HD11 ' A' ' 24' ' ' ILE . 7.0 mt -71.28 -41.85 74.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.205 -0.934 . . . . 0.0 108.587 178.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.75 -156.26 8.15 Favored Glycine 0 N--CA 1.488 2.153 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 54.5 p -116.5 142.56 46.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.135 -1.215 . . . . 0.0 109.883 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.425 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 72.8 m -87.5 179.96 6.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.946 . . . . 0.0 109.999 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 63.9 t30 -62.48 151.27 37.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.162 -0.961 . . . . 0.0 110.449 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.517 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.4 t80 71.41 -140.46 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.294 -0.879 . . . . 0.0 110.642 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -98.22 3.89 48.9 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.171 -0.956 . . . . 0.0 110.64 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.534 ' CE2' ' HB3' ' A' ' 15' ' ' GLN . 75.9 m-85 -81.24 140.79 34.69 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.093 -1.005 . . . . 0.0 110.431 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 32' ' ' LYS . 11.4 mptt -100.07 161.35 13.66 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.204 -0.935 . . . . 0.0 110.282 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.459 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 84.1 m -99.84 123.82 44.5 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.313 -0.867 . . . . 0.0 109.853 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 23' ' ' LYS . 54.9 m -130.19 163.65 26.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.097 -1.002 . . . . 0.0 110.609 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -127.83 133.4 49.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.252 -0.905 . . . . 0.0 110.424 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -88.8 138.6 31.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.866 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.292 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.237 0.541 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.6 t -64.72 -22.88 67.08 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.221 -0.924 . . . . 0.0 109.771 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -62.98 -44.64 95.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.328 -0.857 . . . . 0.0 109.825 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.7 tpp180 -58.35 -41.08 83.9 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.343 -0.848 . . . . 0.0 109.995 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -63.79 -24.19 67.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.317 -0.864 . . . . 0.0 110.159 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.28 8.56 83.37 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.77 177.96 7.64 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.452 ' O ' HD23 ' A' ' 14' ' ' LEU . 41.1 tt0 -116.71 127.41 54.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.182 -1.187 . . . . 0.0 110.07 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.482 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 60.1 m -93.57 119.08 32.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.177 -0.952 . . . . 0.0 110.308 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.587 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.0 mm? -114.74 154.95 27.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.161 -0.962 . . . . 0.0 110.069 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.609 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 30.4 mt-30 -74.22 -17.24 60.91 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.25 -0.906 . . . . 0.0 110.021 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.455 ' O ' ' C ' ' A' ' 17' ' ' CYS . 50.3 mtt180 -152.16 57.17 0.84 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.181 -0.949 . . . . 0.0 110.266 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 72.0 m -37.16 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.573 -0.704 . . . . 0.0 110.447 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 72.3 mt -89.79 171.1 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.247 -0.908 . . . . 0.0 109.759 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -60.05 -45.49 95.85 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 29.0 tp -48.01 -43.64 30.11 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.611 -0.935 . . . . 0.0 110.951 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 66.8 m-85 -72.97 146.82 45.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.304 -0.873 . . . . 0.0 110.944 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.467 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 73.8 m80 -109.93 159.44 17.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.514 -0.741 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.423 ' NZ ' ' O ' ' A' ' 25' ' ' GLY . 60.6 tttm -94.99 108.32 20.38 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.03 -1.044 . . . . 0.0 110.7 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.7 mm -77.28 -42.19 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.885 . . . . 0.0 108.729 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.431 ' C ' HG21 ' A' ' 26' ' ' THR . . . -153.41 -129.28 1.36 Allowed Glycine 0 N--CA 1.486 2.027 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.431 HG21 ' C ' ' A' ' 25' ' ' GLY . 69.5 p -141.39 155.37 45.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.11 -1.23 . . . . 0.0 110.482 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.485 ' SG ' ' HA ' ' A' ' 33' ' ' CYS . 97.4 m -123.16 -167.79 1.66 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.397 -0.814 . . . . 0.0 109.757 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.451 ' C ' ' O ' ' A' ' 27' ' ' CYS . 19.5 m120 -39.57 147.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.607 -0.683 . . . . 0.0 110.169 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.408 ' C ' ' O ' ' A' ' 28' ' ' ASN . 78.7 t80 -42.39 -41.17 2.78 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -0.938 . . . . 0.0 110.792 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -85.24 4.35 35.15 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.114 -0.991 . . . . 0.0 110.853 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.609 ' CE2' ' CG ' ' A' ' 15' ' ' GLN . 96.0 m-85 -139.96 157.03 46.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.071 -1.018 . . . . 0.0 110.66 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 57.5 mttp -127.39 157.64 39.45 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.426 -0.797 . . . . 0.0 109.825 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.485 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 44.5 t -80.93 127.13 32.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.273 -0.892 . . . . 0.0 110.924 -179.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.7 m -141.6 140.32 33.32 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.503 -0.748 . . . . 0.0 109.916 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -136.21 152.7 51.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.15 -0.969 . . . . 0.0 110.329 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.562 ' CE1' ' CZ ' ' A' ' 21' ' ' PHE . 67.5 m-85 -61.73 167.38 3.64 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.303 -0.873 . . . . 0.0 110.015 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.142 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.245 0.545 . . . . 0.0 110.462 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.6 m -61.57 -22.25 65.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.774 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -66.71 -44.02 82.76 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.388 -0.82 . . . . 0.0 109.975 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -59.75 -40.63 88.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.409 -0.807 . . . . 0.0 109.97 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -67.95 -27.62 66.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.338 -0.851 . . . . 0.0 110.152 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.04 11.07 59.15 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.18 -177.68 9.8 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -125.07 145.69 49.8 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.287 -1.125 . . . . 0.0 110.275 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.457 ' SG ' ' HA ' ' A' ' 33' ' ' CYS . 84.8 m -124.46 131.0 53.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.361 -0.837 . . . . 0.0 110.141 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.3 mt -120.02 146.08 46.21 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -55.66 -28.05 53.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.162 -0.961 . . . . 0.0 108.671 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.465 ' O ' HG13 ' A' ' 18' ' ' ILE . 99.1 mtt180 -135.71 63.58 1.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.435 ' C ' HG13 ' A' ' 18' ' ' ILE . 42.3 t -49.56 116.74 1.88 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.53 -0.731 . . . . 0.0 111.06 -179.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 16' ' ' ARG . 61.5 mt -151.26 172.68 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.414 -0.804 . . . . 0.0 109.499 179.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.463 ' N ' ' CG2' ' A' ' 18' ' ' ILE . . . 92.53 -162.02 26.53 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.4 mt -53.5 -19.96 4.31 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.388 -1.066 . . . . 0.0 110.474 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -75.57 145.45 41.21 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.282 -0.886 . . . . 0.0 110.365 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.414 ' CD2' HG12 ' A' ' 24' ' ' ILE . 35.2 p-80 -121.58 176.79 5.51 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.447 ' HE3' ' HD2' ' A' ' 32' ' ' LYS . 86.4 tttt -103.7 110.86 23.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.449 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.494 HG22 HD11 ' A' ' 24' ' ' ILE . 7.1 mt -88.23 -34.85 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.85 . . . . 0.0 109.069 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.11 -163.25 21.73 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 m -94.15 165.69 12.49 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.026 -1.279 . . . . 0.0 110.614 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.421 ' CB ' ' O ' ' A' ' 31' ' ' PHE . 1.1 t -122.78 -158.55 0.79 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.379 -0.826 . . . . 0.0 110.183 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -71.95 151.75 43.04 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.649 -0.657 . . . . 0.0 110.565 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 8.9 t80 48.3 -124.88 1.83 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.473 -0.767 . . . . 0.0 110.778 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -104.92 14.52 29.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.882 -1.136 . . . . 0.0 111.197 -179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.421 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 60.1 m-85 -84.07 142.55 30.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.012 -1.055 . . . . 0.0 110.189 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HD2' ' HE3' ' A' ' 23' ' ' LYS . 75.2 mmtt -90.07 159.16 16.96 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.28 -0.888 . . . . 0.0 110.65 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.457 ' HA ' ' SG ' ' A' ' 13' ' ' CYS . 16.8 t -89.6 131.81 35.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.309 -0.869 . . . . 0.0 109.985 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.406 ' SG ' ' O ' ' A' ' 22' ' ' HIS . 67.3 m -149.54 137.01 20.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.155 -0.966 . . . . 0.0 110.518 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HB2' HD12 ' A' ' 24' ' ' ILE . 58.7 mtpt -125.96 157.8 36.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.451 -0.78 . . . . 0.0 110.024 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -95.51 132.43 40.62 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.245 -0.909 . . . . 0.0 110.29 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.216 179.932 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.276 0.56 . . . . 0.0 110.437 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 80.5 m -58.52 -23.09 57.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -68.75 -44.04 74.57 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.343 -0.848 . . . . 0.0 110.267 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -65.12 -41.84 94.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -0.928 . . . . 0.0 110.143 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.65 -29.48 68.07 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.158 -0.964 . . . . 0.0 110.093 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.85 3.74 68.0 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -74.47 -169.55 22.21 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 34' ' ' CYS . 87.9 mt-10 -133.2 149.08 52.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -1.091 . . . . 0.0 109.788 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 72.9 m -109.9 129.95 55.59 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.05 -1.031 . . . . 0.0 110.446 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.595 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -118.98 145.65 45.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.355 -0.841 . . . . 0.0 110.191 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -63.13 -29.14 70.56 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.061 -1.024 . . . . 0.0 109.074 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.478 ' O ' ' C ' ' A' ' 17' ' ' CYS . 87.4 mtm180 -138.79 59.49 1.62 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.591 -0.693 . . . . 0.0 109.678 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.478 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.2 t -33.87 132.34 0.24 Allowed 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.5 0.667 . . . . 0.0 111.061 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.426 HG23 ' N ' ' A' ' 19' ' ' GLY . 75.5 mt -91.25 173.65 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.437 -0.789 . . . . 0.0 110.31 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.426 ' N ' HG23 ' A' ' 18' ' ' ILE . . . -59.62 -50.89 62.85 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.442 ' C ' ' CD1' ' A' ' 20' ' ' LEU . 3.3 tm? -44.11 -45.53 8.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.4 -1.059 . . . . 0.0 110.045 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -80.04 135.7 36.41 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.421 -0.799 . . . . 0.0 109.995 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.405 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.5 m-70 -99.43 137.42 37.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.127 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.521 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 85.5 tttt -88.75 119.25 29.06 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.317 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.515 HG13 ' N ' ' A' ' 25' ' ' GLY . 37.4 pt -86.16 -30.35 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.257 -0.902 . . . . 0.0 110.124 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.521 ' O ' ' CE ' ' A' ' 23' ' ' LYS . . . -168.23 -135.64 1.91 Allowed Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -121.22 140.43 52.04 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.239 -1.154 . . . . 0.0 110.523 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.443 ' HB2' ' C ' ' A' ' 32' ' ' LYS . 1.6 t -110.79 -161.6 0.76 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 27' ' ' CYS . 83.5 m-20 -46.23 141.99 3.12 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 119.693 -0.803 . . . . 0.0 109.447 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.98 -21.36 0.13 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.075 -1.015 . . . . 0.0 110.797 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 16.2 tpt180 -93.24 -3.64 53.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.003 -1.061 . . . . 0.0 110.424 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -148.11 157.01 43.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.854 -1.154 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 73.3 mmtt -101.88 158.34 16.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.365 -0.834 . . . . 0.0 109.69 179.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.511 ' SG ' ' CG1' ' A' ' 24' ' ' ILE . 7.0 t -85.85 115.07 23.27 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.143 -0.973 . . . . 0.0 110.421 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.491 ' O ' ' N ' ' A' ' 12' ' ' GLU . 85.0 m -131.96 142.57 49.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.356 -0.84 . . . . 0.0 110.07 179.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -123.72 129.1 50.57 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.989 . . . . 0.0 110.371 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -80.71 139.93 35.86 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.917 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.113 179.906 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.208 0.527 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.5 t -59.54 -23.08 62.56 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.222 -0.924 . . . . 0.0 109.943 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -70.37 -40.18 74.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.257 -0.902 . . . . 0.0 110.004 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -66.63 -33.45 75.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.306 -0.871 . . . . 0.0 109.875 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -65.34 -34.54 78.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 19.78 78.09 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.61 -152.3 7.16 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -121.06 146.85 46.28 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -1.192 . . . . 0.0 109.836 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.582 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 74.2 m -121.73 116.4 24.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.967 . . . . 0.0 110.367 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.59 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -120.93 147.32 45.6 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.321 -0.862 . . . . 0.0 109.764 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.454 ' OE1' ' HA ' ' A' ' 31' ' ' PHE . 16.2 mm-40 -54.78 -21.42 11.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.98 -1.075 . . . . 0.0 109.347 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -169.34 71.76 0.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.583 -0.698 . . . . 0.0 109.701 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.483 ' O ' HG21 ' A' ' 18' ' ' ILE . 28.7 p -63.99 145.29 56.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.0 110.741 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.483 HG21 ' O ' ' A' ' 17' ' ' CYS . 32.5 pt -141.1 159.23 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.641 -0.662 . . . . 0.0 110.153 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.57 -145.81 17.33 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.498 ' O ' ' CD2' ' A' ' 22' ' ' HIS . 26.3 mt -61.85 -16.18 48.2 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.399 -1.06 . . . . 0.0 110.228 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -72.59 135.34 45.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.339 -0.85 . . . . 0.0 111.028 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.498 ' CD2' ' O ' ' A' ' 20' ' ' LEU . 94.6 m-70 -121.53 151.76 39.95 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.412 -0.805 . . . . 0.0 109.016 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 60.2 tttm -93.54 126.64 38.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.868 -1.145 . . . . 0.0 111.66 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mt -101.49 -37.17 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.46 -148.59 5.17 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 43.5 p -136.31 149.0 48.23 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.072 -1.252 . . . . 0.0 110.469 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 8.1 m -115.69 163.91 15.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.355 -0.841 . . . . 0.0 109.732 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.52 ' O ' ' N ' ' A' ' 30' ' ' ARG . 54.8 t-20 38.98 29.72 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.432 -0.792 . . . . 0.0 110.692 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.478 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 85.1 t80 60.34 -74.75 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.437 -0.789 . . . . 0.0 110.509 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 28' ' ' ASN . 81.6 mtt180 -58.39 -49.35 77.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.2 -0.938 . . . . 0.0 110.513 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.454 ' HA ' ' OE1' ' A' ' 15' ' ' GLN . 90.5 m-85 -71.05 158.47 36.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.19 -0.943 . . . . 0.0 110.516 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 71.3 mmtt -108.58 168.35 9.4 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.465 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.0 t -107.0 133.87 51.0 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.185 -0.947 . . . . 0.0 109.787 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 96.1 m -140.52 134.69 30.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.453 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -110.79 148.65 31.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.354 -0.841 . . . . 0.0 110.401 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -81.87 145.21 30.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.223 -0.923 . . . . 0.0 109.925 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.489 ' OE1' ' CD2' ' A' ' 22' ' ' HIS . 61.6 tt0 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.263 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.427 ' HB2' ' HD2' ' A' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.384 0.611 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.9 t -52.75 -27.2 16.78 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -69.69 -33.68 72.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.363 -0.836 . . . . 0.0 110.129 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.427 ' HD2' ' HB2' ' A' ' 5' ' ' ALA . 79.8 mtt85 -73.95 -29.74 62.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.2 -0.938 . . . . 0.0 109.924 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.29 -24.42 63.95 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.72 4.52 36.71 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.408 ' CA ' ' HG2' ' A' ' 35' ' ' LYS . . . -86.78 -173.9 49.05 Favored Glycine 0 N--CA 1.49 2.233 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -124.96 142.8 51.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.21 -1.171 . . . . 0.0 110.224 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 48.0 m -92.99 133.14 36.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.272 -0.892 . . . . 0.0 110.185 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.467 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 2.9 mm? -130.8 142.45 50.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.222 -0.924 . . . . 0.0 110.142 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.455 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 89.0 mt-30 -74.27 -21.68 59.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.294 -0.879 . . . . 0.0 110.569 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.424 ' O ' ' C ' ' A' ' 17' ' ' CYS . 92.1 mtt180 -148.83 62.01 1.06 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.108 -0.995 . . . . 0.0 110.639 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 92.5 m -41.86 144.18 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.159 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.429 ' CG1' ' H ' ' A' ' 19' ' ' GLY . 16.8 tt -119.5 176.73 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.168 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.429 ' H ' ' CG1' ' A' ' 18' ' ' ILE . . . -48.08 -45.21 26.68 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 99.5 mt -52.68 -29.47 26.75 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.608 -0.936 . . . . 0.0 110.652 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.484 ' CE2' ' HB2' ' A' ' 36' ' ' PHE . 87.9 m-85 -113.38 146.06 40.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.126 -0.984 . . . . 0.0 110.542 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.419 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.1 m-70 -106.87 134.12 50.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.736 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.489 ' CD ' ' HD2' ' A' ' 32' ' ' LYS . 39.0 ttpt -92.92 97.65 10.87 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.117 -0.989 . . . . 0.0 110.617 -179.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.516 ' CG2' ' SG ' ' A' ' 33' ' ' CYS . 18.9 tt -64.41 -43.39 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.161 -0.962 . . . . 0.0 109.832 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.46 ' N ' ' CG2' ' A' ' 24' ' ' ILE . . . -155.17 -148.11 4.91 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.4 p -120.99 150.11 41.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.251 -1.147 . . . . 0.0 110.133 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 32' ' ' LYS . 92.4 m -77.68 -169.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 110.423 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.435 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 81.0 m-20 -51.71 -39.75 58.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.215 -0.928 . . . . 0.0 110.481 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.538 ' CD2' ' HB2' ' A' ' 30' ' ' ARG . 60.0 t80 -179.32 150.59 0.44 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.49 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.538 ' HB2' ' CD2' ' A' ' 29' ' ' PHE . 68.2 ttt180 66.16 -59.15 0.33 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.437 -0.789 . . . . 0.0 111.127 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.455 ' N ' ' O ' ' A' ' 29' ' ' PHE . 96.6 m-85 -79.48 157.12 27.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 0.0 110.647 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.489 ' HD2' ' CD ' ' A' ' 23' ' ' LYS . 50.3 mtmt -110.14 158.33 18.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.484 -0.76 . . . . 0.0 109.989 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.516 ' SG ' ' CG2' ' A' ' 24' ' ' ILE . 37.7 t -86.89 118.21 26.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.185 -0.947 . . . . 0.0 110.464 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 23' ' ' LYS . 55.6 m -138.71 132.4 30.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.367 -0.833 . . . . 0.0 110.024 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HG2' ' CA ' ' A' ' 11' ' ' GLY . 98.6 mttt -113.37 139.81 48.57 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.295 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.484 ' HB2' ' CE2' ' A' ' 21' ' ' PHE . 91.2 t80 -108.13 142.89 37.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.324 -0.86 . . . . 0.0 110.149 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.192 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.275 0.559 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.523 ' CA ' ' HA2' ' A' ' 10' ' ' GLY . 59.5 m -71.9 -15.86 62.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -73.26 -29.64 62.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.293 -0.879 . . . . 0.0 110.444 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -83.89 -45.42 13.23 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.396 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -135.23 0.78 2.86 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.208 -0.932 . . . . 0.0 110.617 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.523 ' HA2' ' CA ' ' A' ' 6' ' ' CYS . . . -56.9 -23.2 44.63 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 72.15 -99.25 0.86 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -136.78 159.11 42.83 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -1.177 . . . . 0.0 110.303 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.453 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 57.7 m -120.24 150.04 41.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.21 -0.931 . . . . 0.0 110.655 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.453 HD22 ' O ' ' A' ' 16' ' ' ARG . 4.7 tp -148.45 160.28 43.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.351 -0.843 . . . . 0.0 109.872 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -69.22 -52.16 30.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.544 -0.723 . . . . 0.0 110.064 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.453 ' O ' HD22 ' A' ' 14' ' ' LEU . 40.6 mmt180 -106.61 80.64 1.49 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.329 -0.857 . . . . 0.0 110.022 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.447 ' O ' HD11 ' A' ' 18' ' ' ILE . 7.2 t -77.11 81.07 3.63 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.447 HD11 ' O ' ' A' ' 17' ' ' CYS . 18.7 mm -136.85 166.84 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 110.487 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 86.66 -128.06 8.7 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 23.7 tp -67.97 -32.17 72.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -1.141 . . . . 0.0 110.813 -179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 36' ' ' PHE . 90.7 m-85 -80.44 132.65 35.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.204 -0.935 . . . . 0.0 110.415 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -107.11 141.67 37.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.299 -0.875 . . . . 0.0 109.889 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.46 ' CD ' ' HD3' ' A' ' 32' ' ' LYS . 21.0 ttpt -89.42 114.01 25.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.142 -0.974 . . . . 0.0 110.473 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.498 HG22 HD11 ' A' ' 24' ' ' ILE . 22.7 mm -77.74 -41.89 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.309 -0.869 . . . . 0.0 108.761 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.419 ' C ' HG21 ' A' ' 26' ' ' THR . . . -164.12 -129.28 1.02 Allowed Glycine 0 N--CA 1.486 2.023 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.419 HG21 ' C ' ' A' ' 25' ' ' GLY . 38.8 p -127.13 150.4 49.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.167 -1.196 . . . . 0.0 109.855 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.434 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -84.67 -160.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -0.997 . . . . 0.0 111.021 -179.62 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -62.48 -42.98 99.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.86 -0.525 . . . . 0.0 110.963 -179.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.565 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 81.7 t80 -177.08 143.98 0.42 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.17 -0.956 . . . . 0.0 110.543 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.538 ' O ' ' CD1' ' A' ' 31' ' ' PHE . 12.0 tpp180 52.33 19.63 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.284 -0.885 . . . . 0.0 110.255 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.565 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 47.9 m-85 -149.62 154.63 38.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 0.0 110.044 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.46 ' HD3' ' CD ' ' A' ' 23' ' ' LYS . 62.8 mttp -112.5 158.1 20.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.233 -0.917 . . . . 0.0 110.455 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.0 t -85.21 124.5 31.93 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.315 -0.866 . . . . 0.0 109.838 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 65.3 m -135.54 141.59 45.25 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.181 -0.95 . . . . 0.0 110.531 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -116.59 127.31 54.37 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.31 -0.869 . . . . 0.0 109.909 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.401 ' CD1' ' CE1' ' A' ' 21' ' ' PHE . 92.2 t80 -98.41 139.72 33.74 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.173 -0.954 . . . . 0.0 110.562 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.085 179.747 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.623 ' CB ' ' CE2' ' A' ' 7' ' ' TYR . . . . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.342 0.591 . . . . 0.0 109.767 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -74.73 -21.2 59.49 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.432 -0.792 . . . . 0.0 110.02 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.63 ' CD1' ' N ' ' A' ' 8' ' ' ARG . 53.2 p90 -69.31 -44.73 71.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.413 -0.804 . . . . 0.0 109.647 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.63 ' N ' ' CD1' ' A' ' 7' ' ' TYR . 38.9 ttm180 -57.68 -42.66 84.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.37 -0.831 . . . . 0.0 109.906 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.02 -29.68 69.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.068 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.16 9.56 61.94 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.15 176.68 26.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -132.21 146.47 52.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.246 -1.15 . . . . 0.0 110.326 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 79.1 m -103.57 130.76 51.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.255 -0.903 . . . . 0.0 109.95 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.0 mt -112.32 141.58 45.87 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.148 -0.97 . . . . 0.0 110.499 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -56.64 -24.74 50.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 0.0 109.665 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.415 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.9 mtt-85 -137.91 55.12 1.78 Allowed 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.6 t -39.81 130.71 1.94 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.528 -0.733 . . . . 0.0 110.725 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.7 mm -100.23 171.03 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.473 -0.767 . . . . 0.0 110.203 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.403 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -59.09 -46.41 93.8 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.403 ' C ' ' O ' ' A' ' 19' ' ' GLY . 34.0 tp -42.1 -37.92 1.54 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.607 -0.937 . . . . 0.0 110.179 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.422 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 88.4 m-85 -89.22 113.55 24.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.357 -0.839 . . . . 0.0 110.433 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.458 ' O ' ' N ' ' A' ' 35' ' ' LYS . 85.3 t60 -62.53 138.84 58.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.284 -0.885 . . . . 0.0 109.834 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -99.54 112.13 24.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 110.451 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 15.1 mt -72.63 -39.61 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.289 -0.882 . . . . 0.0 108.658 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -174.56 -129.7 1.21 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.8 p -120.22 155.8 32.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.209 -1.171 . . . . 0.0 110.028 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' PHE . 0.6 OUTLIER -94.59 -159.38 0.7 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -0.999 . . . . 0.0 110.438 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.449 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 43.9 t30 -43.09 -53.12 5.08 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.699 -0.625 . . . . 0.0 110.222 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 58.7 t80 -178.66 -61.84 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.49 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -68.8 -34.63 75.85 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.27 -0.894 . . . . 0.0 110.98 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.495 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 91.2 m-85 -103.51 156.11 18.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.018 -1.051 . . . . 0.0 110.591 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -102.7 159.25 15.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.389 -0.819 . . . . 0.0 109.936 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.2 t -82.88 127.97 33.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.24 -0.913 . . . . 0.0 110.122 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 57.5 m -134.01 152.86 52.02 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.148 -0.97 . . . . 0.0 110.404 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.458 ' N ' ' O ' ' A' ' 22' ' ' HIS . 52.9 tttp -127.62 119.77 26.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.357 -0.839 . . . . 0.0 110.156 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -77.22 141.38 40.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.245 -0.91 . . . . 0.0 110.264 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.441 ' CG ' ' OXT' ' A' ' 37' ' ' GLN . 3.6 tt0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 117.934 -1.032 . . . . 0.0 110.167 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.205 0.526 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.6 p -62.71 -38.21 89.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.257 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -123.76 153.78 40.45 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 0.0 110.177 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -126.29 162.48 25.38 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.234 -0.916 . . . . 0.0 110.231 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.35 111.96 13.58 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -0.891 . . . . 0.0 110.193 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.95 -24.42 67.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.93 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -66.55 -43.86 83.94 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.888 . . . . 0.0 110.018 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 38.7 mmt180 -63.31 -35.22 79.65 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.295 -0.878 . . . . 0.0 109.981 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -66.19 -31.02 71.6 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 110.148 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.61 32.75 29.65 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.14 -172.01 48.5 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -117.76 147.69 42.75 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.268 -1.136 . . . . 0.0 110.294 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 16.1 m -99.08 120.24 39.15 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.532 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -116.11 138.19 51.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.126 -0.984 . . . . 0.0 110.402 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.506 ' HG2' ' CE1' ' A' ' 31' ' ' PHE . 74.1 mt-30 -65.52 -27.51 68.52 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.347 -0.846 . . . . 0.0 109.915 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.7 mtm180 -141.33 58.49 1.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.413 -0.805 . . . . 0.0 110.101 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.442 ' C ' ' O ' ' A' ' 16' ' ' ARG . 19.1 t -38.58 124.57 1.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.482 -0.761 . . . . 0.0 110.823 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 72.0 mt -91.59 173.93 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.051 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.426 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -56.88 -48.7 76.59 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.467 ' CD1' ' C ' ' A' ' 20' ' ' LEU . 3.1 tm? -40.81 -40.8 1.43 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.541 -0.976 . . . . 0.0 110.439 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.454 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 93.4 m-85 -88.39 118.71 28.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.43 -0.794 . . . . 0.0 110.497 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.468 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 97.2 m-70 -67.59 150.07 49.26 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.132 -0.98 . . . . 0.0 109.507 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -105.28 125.55 51.11 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.041 -1.037 . . . . 0.0 111.026 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.42 HD11 HG22 ' A' ' 24' ' ' ILE . 10.0 mm -100.76 -37.53 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 CA-C-O 121.737 0.78 . . . . 0.0 109.021 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -171.83 -150.42 7.17 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.325 -1.51 . . . . 0.0 109.325 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.2 p -119.15 160.2 22.55 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -1.219 . . . . 0.0 110.345 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.476 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 86.4 m -87.1 -164.92 1.16 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.219 -0.925 . . . . 0.0 110.627 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -64.92 -42.18 94.91 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.552 -0.718 . . . . 0.0 110.861 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.64 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 66.8 t80 -175.09 140.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -0.924 . . . . 0.0 110.473 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.64 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 38.4 mmt180 57.47 20.68 6.26 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.392 -0.818 . . . . 0.0 110.449 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.506 ' CE1' ' HG2' ' A' ' 15' ' ' GLN . 43.7 m-85 -148.12 152.43 37.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.187 -0.946 . . . . 0.0 110.113 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 27' ' ' CYS . 92.9 mttt -117.81 158.07 25.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.174 -0.954 . . . . 0.0 109.921 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.3 t -94.81 119.34 33.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 87.0 m -136.37 165.12 26.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.387 -0.821 . . . . 0.0 110.063 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -127.83 141.66 51.51 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -106.59 139.14 41.51 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.312 -0.867 . . . . 0.0 110.058 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.273 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 27.1 m120 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.331 0.586 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.1 m 52.21 47.38 24.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.175 -0.953 . . . . 0.0 110.26 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -118.81 138.84 52.42 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.264 -0.898 . . . . 0.0 109.982 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 45.0 mtm-85 -128.07 167.77 16.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.182 -0.949 . . . . 0.0 110.256 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -92.3 108.44 19.96 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.325 -0.859 . . . . 0.0 110.45 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.5 t -59.39 -25.78 64.57 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.182 -0.948 . . . . 0.0 109.899 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -63.58 -41.89 98.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.295 -0.878 . . . . 0.0 110.114 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 53.6 mtm180 -75.17 -33.27 61.45 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.318 -0.864 . . . . 0.0 110.261 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.448 ' OE1' HD11 ' A' ' 24' ' ' ILE . 82.1 mt-10 -65.77 -25.78 67.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.317 -0.864 . . . . 0.0 110.116 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.96 12.83 73.3 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.2 165.21 13.01 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.445 ' OE1' ' HA ' ' A' ' 12' ' ' GLU . 68.4 mm-40 -100.92 141.61 33.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.302 -1.117 . . . . 0.0 110.255 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.7 m -100.19 129.87 46.26 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.168 -0.957 . . . . 0.0 110.436 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.2 tp -124.44 166.67 15.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.085 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -79.23 -30.91 43.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.177 -0.952 . . . . 0.0 109.777 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 17' ' ' CYS . 34.0 ttm180 -146.66 76.33 1.43 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.0 109.312 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.437 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.8 t -36.08 126.07 0.75 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.431 0.634 . . . . 0.0 111.057 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.1 pt -95.95 178.82 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.338 -0.851 . . . . 0.0 110.253 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 20' ' ' LEU . . . -56.9 -175.57 0.29 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 19' ' ' GLY . 60.0 mt 61.13 11.42 3.46 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -1.087 . . . . 0.0 110.332 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -135.78 131.0 34.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.0 110.505 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -99.34 142.09 31.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.421 -0.8 . . . . 0.0 109.481 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 84.7 tttt -95.72 112.04 23.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.055 -1.028 . . . . 0.0 111.166 -179.145 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.448 HD11 ' OE1' ' A' ' 9' ' ' GLU . 5.6 mt -87.99 -34.23 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.305 -0.872 . . . . 0.0 108.737 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.76 -156.68 8.33 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.5 p -123.61 156.33 36.0 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.198 -1.178 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.436 ' CB ' ' HB2' ' A' ' 31' ' ' PHE . 83.6 m -74.94 -166.7 0.5 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.375 -0.828 . . . . 0.0 110.427 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.499 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 47.4 t30 -71.64 -35.7 70.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.605 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.57 ' CE2' ' HG3' ' A' ' 30' ' ' ARG . 54.2 t80 179.64 144.96 0.18 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 110.141 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.57 ' HG3' ' CE2' ' A' ' 29' ' ' PHE . 95.3 mtt180 57.18 19.01 4.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.408 -0.807 . . . . 0.0 110.972 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.436 ' HB2' ' CB ' ' A' ' 27' ' ' CYS . 44.1 m-85 -150.48 158.93 44.71 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.899 -1.125 . . . . 0.0 110.655 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.421 ' C ' ' SG ' ' A' ' 27' ' ' CYS . 35.6 mmtp -126.45 159.11 34.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.324 -0.86 . . . . 0.0 109.938 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.401 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 36.4 t -88.22 125.98 34.91 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.194 -0.941 . . . . 0.0 110.166 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 70.1 m -120.28 137.11 54.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 109.928 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.435 ' HD3' HD13 ' A' ' 24' ' ' ILE . 21.9 tptm -121.41 131.51 54.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.117 -0.99 . . . . 0.0 110.374 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.469 ' O ' ' HB3' ' A' ' 37' ' ' GLN . 62.2 t80 -103.45 128.17 50.67 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.469 ' HB3' ' O ' ' A' ' 36' ' ' PHE . 52.5 tt0 . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 72.9 m-80 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.193 0.52 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.2 p -60.43 -23.49 64.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.265 -0.897 . . . . 0.0 110.18 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -132.23 146.5 52.05 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.266 -0.896 . . . . 0.0 110.293 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -126.57 157.18 39.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.234 -0.916 . . . . 0.0 110.372 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.25 115.2 21.85 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.296 -0.878 . . . . 0.0 110.237 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.1 t -63.19 -21.02 65.94 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.231 -0.918 . . . . 0.0 110.062 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -70.48 -37.38 74.24 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.924 . . . . 0.0 109.747 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttp85 -63.75 -37.18 86.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.482 -0.761 . . . . 0.0 109.946 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -69.06 -33.6 73.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.082 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.25 14.87 79.72 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.92 161.83 49.1 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.361 -1.496 . . . . 0.0 109.361 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.525 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 76.3 tt0 -101.97 139.95 36.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -1.202 . . . . 0.0 110.392 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.461 ' O ' HD12 ' A' ' 14' ' ' LEU . 67.6 m -84.71 130.87 34.64 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.36 -0.838 . . . . 0.0 110.13 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.525 ' CD2' ' O ' ' A' ' 12' ' ' GLU . 3.0 mm? -124.54 135.32 53.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 110.3 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.99 -30.65 71.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.239 -0.913 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 17' ' ' CYS . 70.2 mtm180 -139.92 58.97 1.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.372 -0.83 . . . . 0.0 109.761 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.439 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.1 t -40.03 137.91 0.9 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.448 -0.783 . . . . 0.0 110.616 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 46.6 pt -114.14 179.53 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.363 -0.836 . . . . 0.0 110.499 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -54.5 -48.9 62.93 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.425 ' C ' ' O ' ' A' ' 19' ' ' GLY . 15.5 tp -40.69 -41.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.649 -0.912 . . . . 0.0 110.45 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.458 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 90.1 m-85 -98.31 137.07 37.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.437 -0.789 . . . . 0.0 110.155 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -97.88 126.05 43.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.191 -0.943 . . . . 0.0 109.974 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.95 127.3 32.11 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.229 -0.919 . . . . 0.0 110.756 -179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.3 pt -103.44 -13.28 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.345 -0.847 . . . . 0.0 109.745 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.84 -136.78 3.74 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 3.1 m -138.16 157.61 45.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.097 -1.237 . . . . 0.0 110.227 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.451 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 72.8 m -93.7 -161.08 0.81 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.408 -0.808 . . . . 0.0 109.857 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.486 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.9 t30 -41.11 -46.56 3.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.521 -0.737 . . . . 0.0 110.149 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.486 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 92.3 t80 178.95 -63.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.397 -0.814 . . . . 0.0 110.816 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -61.99 -40.81 96.91 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.339 -0.85 . . . . 0.0 111.38 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 27' ' ' CYS . 97.4 m-85 -96.01 164.27 12.78 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.067 -1.021 . . . . 0.0 111.492 -178.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 59.3 mttp -116.4 160.53 20.42 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.657 -0.652 . . . . 0.0 109.318 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 26' ' ' THR . 67.4 m -92.35 121.45 33.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.946 -1.096 . . . . 0.0 110.673 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 68.8 m -127.85 136.81 51.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.442 -0.786 . . . . 0.0 109.865 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -115.49 133.74 55.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.427 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -99.97 141.97 32.08 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.153 179.818 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 55.5 t30 . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.318 0.58 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -74.46 -35.72 63.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.208 -0.933 . . . . 0.0 110.207 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -57.62 -41.55 81.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.294 -0.879 . . . . 0.0 110.329 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -115.2 152.98 31.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.454 -0.779 . . . . 0.0 110.273 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -99.87 111.5 23.81 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.344 -0.848 . . . . 0.0 110.556 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.2 t -60.02 -23.26 63.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.959 . . . . 0.0 109.841 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -65.18 -37.7 88.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -62.53 -37.65 86.92 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.3 -0.875 . . . . 0.0 109.917 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.48 17.96 72.24 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -177.6 43.25 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HG2' HD23 ' A' ' 14' ' ' LEU . 43.8 tt0 -105.86 135.05 48.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.28 -1.13 . . . . 0.0 110.102 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 87.9 m -92.91 130.52 38.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 110.239 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.523 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 3.2 mm? -132.09 143.64 50.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.386 -0.821 . . . . 0.0 110.119 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.539 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 11.2 pt20 -63.2 -33.22 75.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.213 -0.929 . . . . 0.0 109.428 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' A' ' 15' ' ' GLN . 78.8 mtt85 -158.4 61.97 0.44 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.601 -0.687 . . . . 0.0 109.714 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.547 ' O ' ' CG2' ' A' ' 18' ' ' ILE . 22.2 p -60.52 146.88 43.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.19 -0.944 . . . . 0.0 110.494 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.547 ' CG2' ' O ' ' A' ' 17' ' ' CYS . 29.5 pt -158.82 158.25 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.433 -0.792 . . . . 0.0 110.454 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.57 -119.75 4.98 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.6 mt -61.94 -23.16 66.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.31 -1.112 . . . . 0.0 110.554 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -103.73 129.16 51.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.133 -0.98 . . . . 0.0 111.042 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.509 ' HB3' ' NE2' ' A' ' 37' ' ' GLN . 82.7 t60 -119.27 139.44 51.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.387 -0.82 . . . . 0.0 109.174 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -74.27 123.04 23.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.028 -1.045 . . . . 0.0 111.132 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.494 HG13 ' CG ' ' A' ' 35' ' ' LYS . 14.6 mm -93.38 -37.47 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -156.42 -143.49 3.68 Favored Glycine 0 N--CA 1.487 2.059 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.6 p -127.78 164.49 22.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.127 -1.219 . . . . 0.0 110.466 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.7 m -123.31 -176.96 3.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.243 -0.91 . . . . 0.0 110.125 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.512 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 51.6 t-20 -60.03 146.17 43.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 110.157 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.5 t80 70.98 -150.97 0.09 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.305 -0.872 . . . . 0.0 110.417 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -87.71 -5.4 58.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.255 -0.903 . . . . 0.0 110.732 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -72.09 138.9 48.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.183 -0.948 . . . . 0.0 110.234 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 94.2 mttt -103.18 164.93 11.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 13' ' ' CYS . 23.8 m -93.97 134.83 35.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 110.369 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 78.2 m -138.97 134.68 33.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.255 -0.903 . . . . 0.0 109.98 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.494 ' CG ' HG13 ' A' ' 24' ' ' ILE . 98.7 mttt -113.94 143.32 44.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.136 -0.978 . . . . 0.0 110.294 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 138.45 51.68 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 110.15 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.509 ' NE2' ' HB3' ' A' ' 22' ' ' HIS . 68.3 mt-30 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.251 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.176 0.512 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.4 t -59.39 -43.57 92.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 110.053 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -99.09 139.85 34.13 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.186 -0.946 . . . . 0.0 110.264 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 54.2 ttp180 -79.28 153.28 30.0 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.248 -0.907 . . . . 0.0 109.795 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.05 98.82 5.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.241 -0.912 . . . . 0.0 110.451 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.9 m -54.55 -34.76 62.38 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.389 -0.82 . . . . 0.0 109.646 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -61.08 -42.63 98.86 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.519 -0.738 . . . . 0.0 109.847 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttt-85 -63.69 -35.49 80.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.44 -0.788 . . . . 0.0 110.235 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -71.39 -21.21 62.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 110.252 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.24 19.34 33.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -165.37 40.33 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.462 ' HG3' HD23 ' A' ' 14' ' ' LEU . 39.5 tp10 -135.88 148.49 48.64 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.242 -1.151 . . . . 0.0 110.178 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 67.1 m -111.27 121.04 44.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.229 -0.919 . . . . 0.0 110.374 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.545 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -119.8 150.57 40.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.232 -0.918 . . . . 0.0 110.091 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -62.38 -35.2 78.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 0.0 109.699 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.43 ' O ' HG22 ' A' ' 18' ' ' ILE . 57.6 mtp180 -141.96 58.76 1.48 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.422 -0.799 . . . . 0.0 109.723 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.477 ' O ' HG21 ' A' ' 18' ' ' ILE . 2.0 t -50.73 121.59 6.09 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.333 -0.855 . . . . 0.0 110.57 -179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.477 HG21 ' O ' ' A' ' 17' ' ' CYS . 25.9 pt -140.9 164.92 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.46 -0.775 . . . . 0.0 110.036 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.05 -151.71 17.61 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.5 mt -59.48 -17.99 36.16 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -1.167 . . . . 0.0 110.02 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -68.91 140.49 55.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.402 -0.811 . . . . 0.0 110.91 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.479 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 89.2 m-70 -114.63 162.51 16.68 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.316 -0.865 . . . . 0.0 109.413 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -91.48 111.96 23.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.929 -1.107 . . . . 0.0 110.848 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.433 HD11 HG22 ' A' ' 24' ' ' ILE . 10.4 mm -87.86 -35.19 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.06 -148.79 5.83 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 25.0 p -129.53 152.19 49.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.311 -1.111 . . . . 0.0 110.007 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.542 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 80.1 m -106.14 -174.75 2.61 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.109 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.522 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 93.3 m-20 -99.37 160.88 13.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.292 -0.88 . . . . 0.0 110.428 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.601 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 1.5 t80 71.16 39.03 1.0 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.28 -0.887 . . . . 0.0 110.271 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.507 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 95.5 mtt180 62.52 62.36 1.13 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 110.415 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.601 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 42.3 m-85 -145.68 155.06 42.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.218 -0.926 . . . . 0.0 110.055 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.458 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 48.2 mtmt -113.95 166.95 11.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.15 -0.969 . . . . 0.0 110.338 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.8 t -108.94 128.23 54.75 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 19.5 p -153.08 145.32 23.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.277 -0.889 . . . . 0.0 110.019 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -124.32 156.34 37.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.483 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -79.84 139.88 37.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.356 -0.84 . . . . 0.0 110.02 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.221 -179.802 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 65.5 m-80 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.179 0.514 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.6 t -101.14 139.26 37.07 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.166 -0.959 . . . . 0.0 110.136 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 60.9 mttm -61.96 -40.5 95.8 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.275 -0.89 . . . . 0.0 110.23 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.472 ' O ' ' O ' ' A' ' 5' ' ' ALA . 48.6 ttt180 -62.61 160.12 14.63 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.308 -0.87 . . . . 0.0 110.117 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.472 ' O ' ' O ' ' A' ' 4' ' ' ARG . . . 48.27 100.2 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.279 -0.888 . . . . 0.0 110.264 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.2 t -70.76 -28.57 64.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -59.7 -39.53 84.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 85.6 mtt180 -60.55 -42.27 96.21 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.314 -0.866 . . . . 0.0 110.116 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.295 -0.878 . . . . 0.0 110.019 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.38 -3.3 85.36 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.37 174.4 7.86 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 94.4 mt-10 -113.15 137.07 52.0 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.246 -1.15 . . . . 0.0 110.353 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 15.7 m -85.39 124.09 31.59 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.28 -0.888 . . . . 0.0 109.99 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.528 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 3.3 mm? -124.57 146.15 49.2 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.13 -0.981 . . . . 0.0 110.161 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -63.74 -37.06 85.95 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.26 -0.9 . . . . 0.0 109.99 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.457 ' O ' HG22 ' A' ' 18' ' ' ILE . 37.2 ptt180 -137.01 58.12 1.73 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.23 -0.919 . . . . 0.0 109.607 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.527 ' O ' ' CG2' ' A' ' 18' ' ' ILE . 53.8 t -51.73 122.85 8.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.474 -0.766 . . . . 0.0 110.837 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.527 ' CG2' ' O ' ' A' ' 17' ' ' CYS . 19.4 pt -158.32 163.71 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.306 -0.871 . . . . 0.0 110.104 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.02 -145.62 16.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.73 -29.99 71.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.299 -1.118 . . . . 0.0 110.633 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 36' ' ' PHE . 95.5 m-85 -60.83 135.2 57.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.925 . . . . 0.0 110.422 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.432 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 98.0 m-70 -104.76 128.98 53.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.284 -0.885 . . . . 0.0 109.596 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.6 ttpt -81.32 115.76 20.84 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.144 -0.972 . . . . 0.0 110.828 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.452 HD11 HG23 ' A' ' 24' ' ' ILE . 11.1 mt -77.24 -47.4 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 108.868 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -158.79 -168.38 20.82 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -94.08 158.33 15.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.071 -1.252 . . . . 0.0 110.154 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.528 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 57.4 m -85.07 -163.7 0.88 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.207 -0.933 . . . . 0.0 110.668 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.47 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 68.7 m-20 -63.18 -33.01 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 111.197 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.643 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 72.7 t80 -179.62 140.19 0.14 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.022 -1.049 . . . . 0.0 110.878 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.643 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 27.2 mmt85 49.03 25.4 1.09 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.277 -0.889 . . . . 0.0 110.658 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.528 ' CB ' ' HB2' ' A' ' 27' ' ' CYS . 33.6 m-85 -147.45 152.17 37.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.172 -0.955 . . . . 0.0 110.258 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.45 ' O ' ' SG ' ' A' ' 27' ' ' CYS . 52.4 mtmt -115.41 155.31 27.65 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.931 . . . . 0.0 110.181 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 18.0 t -98.91 125.23 44.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.427 -0.795 . . . . 0.0 110.327 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.2 m -132.63 163.88 27.93 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.279 -0.888 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -131.93 140.56 49.06 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.365 -0.834 . . . . 0.0 109.97 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.54 ' HB3' ' CE1' ' A' ' 21' ' ' PHE . 44.6 p90 -123.64 161.43 25.06 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 110.256 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.409 -179.911 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 57.5 t30 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.182 0.515 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -79.0 144.48 34.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.326 -0.859 . . . . 0.0 110.126 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -74.97 143.92 43.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.144 -0.972 . . . . 0.0 110.366 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -122.64 151.97 40.95 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.227 -0.921 . . . . 0.0 110.028 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.3 101.55 12.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.202 -0.936 . . . . 0.0 109.92 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.81 -25.57 68.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.391 -0.818 . . . . 0.0 110.194 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -64.24 -38.93 92.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.357 -0.84 . . . . 0.0 110.078 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -57.82 -34.71 69.95 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.2 -0.937 . . . . 0.0 110.037 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -58.75 -29.23 66.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.235 -0.916 . . . . 0.0 110.109 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.85 10.76 34.2 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.54 -176.81 16.16 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 49.2 tp10 -110.01 130.28 55.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.258 -1.143 . . . . 0.0 109.952 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 96.7 m -106.32 134.0 50.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.304 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.575 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 3.4 mm? -120.75 151.4 39.61 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.361 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -67.85 -24.91 65.31 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.373 -0.829 . . . . 0.0 109.619 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.451 ' O ' ' C ' ' A' ' 17' ' ' CYS . 81.3 mtm180 -145.71 59.23 1.26 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.454 -0.779 . . . . 0.0 109.897 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.451 ' C ' ' O ' ' A' ' 16' ' ' ARG . 38.4 t -36.24 122.08 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.572 -0.705 . . . . 0.0 110.555 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.6 mt -77.13 170.77 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.398 -0.814 . . . . 0.0 110.152 -179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -58.93 -49.36 79.12 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.284 -1.527 . . . . 0.0 109.284 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' GLY . 16.6 tp -42.96 -40.05 2.84 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.439 -1.036 . . . . 0.0 110.231 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.437 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 68.9 m-85 -82.33 140.27 33.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.353 -0.842 . . . . 0.0 110.219 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.424 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 68.2 m80 -97.62 139.1 34.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.334 -0.854 . . . . 0.0 109.707 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 64.4 tttt -94.58 119.34 33.1 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.078 -1.014 . . . . 0.0 110.566 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.525 HD13 ' CD ' ' A' ' 35' ' ' LYS . 9.5 mt -90.59 -38.98 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 108.921 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -163.46 -163.72 16.9 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.2 m -104.5 168.24 9.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.084 -1.245 . . . . 0.0 110.259 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.541 ' N ' ' O ' ' A' ' 31' ' ' PHE . 59.7 m -119.18 -171.67 2.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.38 -0.825 . . . . 0.0 109.824 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 55.1 t30 -93.77 153.65 18.19 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.192 -0.942 . . . . 0.0 110.469 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 1.8 t80 72.2 36.64 1.06 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.34 -0.85 . . . . 0.0 110.499 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 99.7 mtt180 60.27 52.11 5.1 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.356 -0.84 . . . . 0.0 111.055 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' CYS . 25.0 m-85 -125.74 140.99 52.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.199 -0.938 . . . . 0.0 109.831 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.494 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 34.2 mmtp -87.9 156.79 19.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.065 -1.022 . . . . 0.0 109.597 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 27.6 t -102.63 123.2 45.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.229 -0.919 . . . . 0.0 109.866 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 50.6 m -141.63 154.17 45.21 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.149 -0.97 . . . . 0.0 110.577 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.525 ' CD ' HD13 ' A' ' 24' ' ' ILE . 53.1 mtpt -134.89 159.35 41.69 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.968 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -112.04 126.1 54.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.09 -1.006 . . . . 0.0 110.377 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.313 179.907 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.249 0.547 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 91.9 p -60.28 -35.87 76.54 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.234 -0.916 . . . . 0.0 109.905 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -125.5 150.47 47.36 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.886 . . . . 0.0 109.98 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -99.95 164.82 11.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.184 -0.947 . . . . 0.0 110.045 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -119.15 112.73 19.88 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.231 -0.918 . . . . 0.0 110.56 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.7 m -57.96 -24.25 57.2 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.397 -0.814 . . . . 0.0 109.762 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -60.96 -36.76 80.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 109.781 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -67.64 -40.22 84.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.361 -0.837 . . . . 0.0 109.889 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -65.73 -25.71 67.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.292 -0.88 . . . . 0.0 110.048 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.89 1.58 57.28 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.801 -1.319 . . . . 0.0 109.801 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.98 -172.01 7.62 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -130.54 143.91 51.06 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.199 -1.177 . . . . 0.0 110.256 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 30.1 m -105.21 122.88 46.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.388 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.589 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.8 mm? -122.98 144.8 49.01 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.37 -0.831 . . . . 0.0 110.1 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -57.54 -19.27 24.02 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.171 -0.955 . . . . 0.0 110.011 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' A' ' 17' ' ' CYS . 32.5 ttm180 -168.62 72.96 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.359 -0.838 . . . . 0.0 109.863 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.434 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 61.2 m -40.03 147.91 0.09 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.513 -0.742 . . . . 0.0 110.54 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.428 HG22 HD11 ' A' ' 18' ' ' ILE . 63.0 mt -84.47 173.84 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.344 -0.847 . . . . 0.0 109.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -53.73 -46.36 67.32 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.489 ' C ' ' CD1' ' A' ' 20' ' ' LEU . 3.4 tm? -51.12 -44.79 61.41 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.483 ' CE2' ' CD1' ' A' ' 36' ' ' PHE . 94.6 m-85 -76.39 149.52 36.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.889 . . . . 0.0 110.829 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.438 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.9 m-70 -114.25 143.56 44.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.357 -0.839 . . . . 0.0 109.665 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 39.8 ttpt -99.36 121.6 41.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.131 -0.98 . . . . 0.0 110.75 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.492 HG22 HD11 ' A' ' 24' ' ' ILE . 6.0 mt -85.77 -33.51 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.321 -0.862 . . . . 0.0 108.941 179.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -167.5 -131.91 1.34 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 108.907 -1.677 . . . . 0.0 108.907 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.5 m -130.19 163.41 26.73 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.134 -1.215 . . . . 0.0 110.207 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.502 ' CB ' ' O ' ' A' ' 31' ' ' PHE . 1.1 t -94.87 -156.61 0.52 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 0.0 110.488 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 78.8 m-20 -64.99 56.84 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.762 -0.586 . . . . 0.0 111.021 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 88.3 t80 53.0 17.11 0.83 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.183 -0.948 . . . . 0.0 110.911 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 28' ' ' ASN . 97.1 mtt180 -125.87 -40.79 2.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.886 -1.133 . . . . 0.0 110.366 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.502 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 99.1 m-85 -128.16 170.05 13.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.224 -0.923 . . . . 0.0 110.077 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 74.6 mmtt -87.62 157.16 19.19 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.893 . . . . 0.0 109.927 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.8 t -94.35 110.77 22.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.305 -0.872 . . . . 0.0 109.954 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 99.3 m -129.42 163.95 24.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.38 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -131.53 132.31 44.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.352 -0.843 . . . . 0.0 110.016 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.483 ' CD1' ' CE2' ' A' ' 21' ' ' PHE . 61.1 t80 -107.26 123.64 48.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.142 -0.974 . . . . 0.0 110.264 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 117.945 -1.026 . . . . 0.0 110.25 -179.863 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 62.0 t30 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.232 0.539 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 t -134.97 139.96 45.32 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.294 -0.878 . . . . 0.0 110.192 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -64.26 -35.92 82.41 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.347 -0.845 . . . . 0.0 110.154 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.499 ' CZ ' ' HB3' ' A' ' 9' ' ' GLU . 21.1 tpt180 -126.37 156.95 39.7 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.271 -0.893 . . . . 0.0 110.239 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.484 ' N ' ' HG3' ' A' ' 4' ' ' ARG . . . -132.82 104.45 6.6 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 110.262 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.6 t -60.53 -26.24 66.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.348 -0.845 . . . . 0.0 110.076 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -65.46 -35.68 81.64 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.297 -0.877 . . . . 0.0 110.162 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.1 mmm180 -99.7 -56.06 2.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.957 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 4' ' ' ARG . 20.7 mm-40 -80.97 -26.56 36.49 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.299 -0.876 . . . . 0.0 109.969 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.468 ' CA ' ' O ' ' A' ' 6' ' ' CYS . . . -89.41 9.07 78.37 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.46 ' HA2' ' O ' ' A' ' 34' ' ' CYS . . . 57.62 -117.2 9.42 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.48 ' HG3' ' CE1' ' A' ' 36' ' ' PHE . 95.5 mt-10 -120.07 145.28 47.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.257 -1.143 . . . . 0.0 110.317 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 85.4 m -93.99 125.44 38.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.272 -0.892 . . . . 0.0 109.673 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 tp -128.47 164.86 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.489 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.577 ' CG ' ' CE1' ' A' ' 31' ' ' PHE . 90.9 mt-30 -73.75 -42.4 61.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.331 -0.855 . . . . 0.0 109.756 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.2 mtt-85 -122.37 63.14 0.95 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.36 -0.837 . . . . 0.0 109.48 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.469 ' C ' ' O ' ' A' ' 16' ' ' ARG . 45.3 t -34.54 118.45 0.4 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.395 0.617 . . . . 0.0 111.137 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.554 HD12 ' CG ' ' A' ' 21' ' ' PHE . 37.9 pt -59.25 168.64 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.325 -0.859 . . . . 0.0 109.999 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -77.2 -50.46 6.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.448 ' HB3' HD13 ' A' ' 18' ' ' ILE . 48.5 tp -40.91 -32.64 0.24 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.544 -0.974 . . . . 0.0 110.565 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.584 ' CZ ' ' HB2' ' A' ' 36' ' ' PHE . 7.0 m-30 -91.99 115.48 28.11 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.405 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 62.6 t-80 -66.22 139.86 58.12 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.322 -0.861 . . . . 0.0 110.285 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 33' ' ' CYS . 39.5 ttpt -101.24 107.66 19.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.225 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.509 HG13 ' N ' ' A' ' 25' ' ' GLY . 32.3 pt -70.56 -27.48 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.27 -0.894 . . . . 0.0 109.965 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.509 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 177.7 -135.48 2.74 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.462 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -127.77 166.15 18.73 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.198 -1.178 . . . . 0.0 110.441 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 74.4 m -100.63 -176.96 3.34 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.655 -0.653 . . . . 0.0 109.684 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.3 t30 -80.67 52.04 1.61 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.009 -1.057 . . . . 0.0 109.52 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.489 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 79.5 t80 -179.91 176.91 0.71 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.691 -0.63 . . . . 0.0 109.893 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.433 ' N ' ' CG ' ' A' ' 29' ' ' PHE . 91.1 mmt-85 -53.59 -16.83 1.73 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.13 -0.981 . . . . 0.0 110.887 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 15' ' ' GLN . 7.1 m-30 -76.64 167.13 22.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.025 -1.047 . . . . 0.0 110.357 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.484 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 43.3 mmtm -120.32 161.37 21.26 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 110.195 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 83.1 m -86.35 133.66 33.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.138 -0.976 . . . . 0.0 110.409 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.46 ' O ' ' HA2' ' A' ' 11' ' ' GLY . 62.6 m -141.36 147.17 37.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.895 . . . . 0.0 110.305 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -107.93 127.86 54.12 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.348 -0.845 . . . . 0.0 110.287 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.584 ' HB2' ' CZ ' ' A' ' 21' ' ' PHE . 41.0 p90 -126.48 162.75 24.89 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.159 -0.963 . . . . 0.0 110.128 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.163 179.842 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 49.5 p-10 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.214 0.531 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 98.8 p -141.54 153.48 44.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.335 -0.853 . . . . 0.0 110.38 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.441 ' HD2' ' HG2' ' A' ' 9' ' ' GLU . 33.5 ttpt -112.82 155.9 23.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.342 -0.849 . . . . 0.0 110.088 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.466 ' O ' ' CB ' ' A' ' 5' ' ' ALA . 35.4 ttm180 -160.03 158.07 29.83 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.106 -0.996 . . . . 0.0 110.438 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.466 ' CB ' ' O ' ' A' ' 4' ' ' ARG . . . 66.14 104.86 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.255 -0.903 . . . . 0.0 110.358 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 t -61.0 -24.98 66.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.184 -0.947 . . . . 0.0 109.716 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -70.15 -29.37 66.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.399 -0.813 . . . . 0.0 109.711 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -67.79 -33.45 74.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.3 -0.875 . . . . 0.0 110.166 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.447 ' OE2' HG12 ' A' ' 24' ' ' ILE . 52.7 mt-10 -59.94 -26.58 66.08 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.263 -0.898 . . . . 0.0 110.269 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.76 -12.52 68.54 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.27 179.87 53.34 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.524 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 79.6 mm-40 -122.36 147.03 46.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.225 -1.162 . . . . 0.0 110.085 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 74.9 m -86.16 124.22 32.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.21 -0.931 . . . . 0.0 110.106 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.551 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 3.1 mm? -110.94 139.34 46.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.553 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.529 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 29.3 pt20 -65.28 -26.55 68.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.324 -0.86 . . . . 0.0 109.894 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' CYS . 76.3 mtm-85 -140.86 55.82 1.57 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.414 -0.804 . . . . 0.0 109.66 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' ARG . 15.9 t -38.69 143.86 0.13 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.574 -0.704 . . . . 0.0 110.589 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.447 HD12 HG22 ' A' ' 18' ' ' ILE . 40.4 pt -120.86 175.74 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.321 -0.862 . . . . 0.0 110.137 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -55.48 -48.13 72.1 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 94.9 mt -44.14 -37.55 3.18 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.445 -1.032 . . . . 0.0 110.223 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -99.16 116.7 31.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.385 -0.822 . . . . 0.0 110.443 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -71.55 136.71 47.59 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.942 . . . . 0.0 109.568 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.522 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 86.3 tttt -86.56 100.9 12.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.069 -1.02 . . . . 0.0 110.487 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.449 HG22 ' N ' ' A' ' 25' ' ' GLY . 13.8 tt -63.03 -41.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.347 -0.846 . . . . 0.0 109.835 179.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.522 ' O ' ' CE ' ' A' ' 23' ' ' LYS . . . -158.63 -132.49 1.4 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.483 HG21 ' CE ' ' A' ' 23' ' ' LYS . 38.9 p -138.77 138.61 37.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -1.156 . . . . 0.0 110.047 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 31' ' ' PHE . 1.4 t -98.1 -159.64 0.75 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.167 -0.958 . . . . 0.0 109.64 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.525 ' OD1' ' N ' ' A' ' 31' ' ' PHE . 22.1 p30 -51.94 164.17 0.29 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.512 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -59.35 -12.62 6.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.98 -1.075 . . . . 0.0 111.346 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.583 ' HG3' ' CE1' ' A' ' 31' ' ' PHE . 46.7 tpt85 -98.78 -10.28 23.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.869 -1.144 . . . . 0.0 110.693 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.583 ' CE1' ' HG3' ' A' ' 30' ' ' ARG . 87.7 m-85 -144.38 154.63 43.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.959 -1.088 . . . . 0.0 110.647 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.49 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 87.3 mttt -106.91 155.22 19.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.428 ' HB2' ' C ' ' A' ' 25' ' ' GLY . 27.1 m -89.09 122.94 32.9 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.111 -0.993 . . . . 0.0 110.852 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 96.7 m -141.59 161.94 36.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.34 -0.85 . . . . 0.0 110.157 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -140.94 157.09 45.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.242 -0.911 . . . . 0.0 110.231 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.7 t80 -108.71 135.56 49.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.217 -0.927 . . . . 0.0 110.091 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.451 ' HG3' ' OXT' ' A' ' 37' ' ' GLN . 8.2 tp60 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.069 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.9 m120 . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.264 0.554 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.5 p -53.67 -32.0 49.85 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.177 -0.952 . . . . 0.0 110.041 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -84.44 141.04 31.1 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.297 -0.877 . . . . 0.0 110.011 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -69.82 160.17 32.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.26 -0.9 . . . . 0.0 110.577 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -110.77 115.74 30.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.352 -0.843 . . . . 0.0 110.36 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.0 t -57.49 -20.92 34.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.918 . . . . 0.0 110.139 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -69.92 -42.68 72.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.841 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -63.77 -34.24 77.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.374 -0.829 . . . . 0.0 109.944 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.415 ' OE1' ' SG ' ' A' ' 33' ' ' CYS . 97.7 mt-10 -64.37 -36.24 83.5 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.359 -0.838 . . . . 0.0 110.322 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.89 -4.58 28.96 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.21 -173.0 49.58 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -123.78 150.98 43.81 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.224 -1.162 . . . . 0.0 110.24 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 25.7 m -92.78 116.17 28.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.207 -0.933 . . . . 0.0 110.311 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.55 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 3.2 mm? -121.37 132.89 55.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.209 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -53.54 -32.72 51.87 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.159 -0.963 . . . . 0.0 109.844 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 -150.89 64.72 0.92 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.348 -0.845 . . . . 0.0 110.25 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.472 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 19.3 p -55.16 168.77 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 110.402 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.523 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 41.4 pt -95.45 159.74 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.45 -0.781 . . . . 0.0 110.272 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.461 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -52.73 -45.87 60.13 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.523 ' HB2' ' CD1' ' A' ' 18' ' ' ILE . 9.9 mp -37.48 -36.02 0.15 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.858 -0.79 . . . . 0.0 110.451 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 8.7 m-30 -88.54 116.05 26.5 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.438 -0.789 . . . . 0.0 110.108 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.483 ' N ' ' O ' ' A' ' 35' ' ' LYS . 60.2 t-80 -68.64 141.95 55.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.046 -1.034 . . . . 0.0 109.95 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.2 ttmt -90.93 114.44 26.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.096 -1.002 . . . . 0.0 110.176 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.9 mt -78.15 -43.37 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.273 -0.892 . . . . 0.0 108.598 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.41 ' C ' HG21 ' A' ' 26' ' ' THR . . . -163.69 -141.7 3.2 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.41 HG21 ' C ' ' A' ' 25' ' ' GLY . 43.0 p -131.18 154.83 47.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.249 -1.148 . . . . 0.0 110.361 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 64.8 m -83.88 -166.84 1.52 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.25 -0.906 . . . . 0.0 110.238 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 59.3 t30 -39.69 -49.51 2.26 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.529 -0.732 . . . . 0.0 110.736 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 89.6 t80 -178.83 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 111.025 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -66.48 -43.25 85.96 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.186 -0.946 . . . . 0.0 111.383 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 27' ' ' CYS . 93.3 m-85 -90.05 162.57 15.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.994 -1.067 . . . . 0.0 111.068 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.461 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 46.5 mttm -117.38 165.06 13.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.461 -0.774 . . . . 0.0 109.522 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 13.8 t -99.17 113.15 25.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.992 -1.068 . . . . 0.0 110.473 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.5 m -130.76 131.88 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.358 -0.839 . . . . 0.0 109.774 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 22' ' ' HIS . 80.9 tttt -134.98 155.66 50.38 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.233 -0.917 . . . . 0.0 110.573 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -95.14 137.11 34.63 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.332 -0.855 . . . . 0.0 110.068 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.291 179.931 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.3 m120 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.358 0.599 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.4 t -133.73 132.85 41.07 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.248 -0.908 . . . . 0.0 110.121 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -57.82 -32.94 68.09 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.16 -0.963 . . . . 0.0 110.022 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -117.92 156.71 27.98 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.347 -0.846 . . . . 0.0 110.088 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -105.07 114.8 29.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.22 -0.925 . . . . 0.0 110.273 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.1 t -60.99 -16.73 46.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -76.92 -40.08 48.47 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.221 -0.924 . . . . 0.0 109.717 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -60.25 -38.75 84.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.416 -0.803 . . . . 0.0 110.017 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.18 -37.12 84.84 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.273 -0.892 . . . . 0.0 110.079 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.08 21.1 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -86.16 -169.67 46.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -126.57 148.02 49.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.329 -1.101 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 97.0 m -102.22 121.96 43.26 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.561 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 3.0 mm? -110.67 147.08 35.07 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.23 -0.918 . . . . 0.0 110.54 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.589 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 27.9 pt20 -75.07 -25.6 58.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -0.897 . . . . 0.0 109.936 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 17' ' ' CYS . 99.3 mtt180 -147.14 64.75 1.16 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.4 -0.812 . . . . 0.0 110.19 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.478 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 73.7 m -38.13 157.28 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.388 -0.82 . . . . 0.0 110.898 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.5 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 43.7 pt -127.38 172.67 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.393 -0.817 . . . . 0.0 109.943 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -46.84 -46.51 19.2 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.538 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 3.8 mm? -49.68 -36.23 24.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.518 -0.99 . . . . 0.0 110.703 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 53.2 m-85 -111.37 140.93 45.54 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.059 -179.122 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -112.93 134.25 54.53 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.33 -0.857 . . . . 0.0 109.353 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 34.9 ttpt -67.27 123.1 19.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.199 -0.938 . . . . 0.0 111.433 -178.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.2 mm -90.65 -35.38 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.417 ' C ' ' HB3' ' A' ' 33' ' ' CYS . . . -152.42 -133.17 1.9 Allowed Glycine 0 N--CA 1.486 1.997 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.5 m -134.28 166.53 22.6 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.163 -1.198 . . . . 0.0 111.031 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 33' ' ' CYS . 91.2 m -143.29 -164.17 1.8 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.651 -0.656 . . . . 0.0 109.411 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.45 ' C ' ' O ' ' A' ' 27' ' ' CYS . 20.7 t-20 -40.53 155.45 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.804 . . . . 0.0 109.961 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -49.97 -35.48 24.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.16 -0.962 . . . . 0.0 111.017 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.41 ' NH1' ' OD1' ' A' ' 28' ' ' ASN . 91.8 mtm-85 -94.46 6.68 48.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.958 -1.089 . . . . 0.0 110.68 -179.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.589 ' CE1' ' HB3' ' A' ' 15' ' ' GLN . 95.9 m-85 -139.0 155.0 48.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.179 -0.951 . . . . 0.0 110.442 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.494 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 63.2 mttp -129.01 156.66 43.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.99 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.498 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 50.5 t -79.34 119.19 22.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.312 -0.868 . . . . 0.0 110.353 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 23' ' ' LYS . 32.9 m -139.31 133.07 30.69 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 110.215 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -124.29 155.02 39.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.177 -0.952 . . . . 0.0 110.156 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -80.85 139.52 35.91 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.346 -0.846 . . . . 0.0 110.108 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 117.936 -1.031 . . . . 0.0 110.233 -179.943 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 63.4 t30 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.28 0.562 . . . . 0.0 110.186 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 t -54.64 -50.14 68.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.242 -0.911 . . . . 0.0 109.944 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -61.84 150.19 37.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.233 -0.917 . . . . 0.0 109.825 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -122.8 151.24 41.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.141 -0.974 . . . . 0.0 110.691 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.636 ' CB ' ' CE1' ' A' ' 7' ' ' TYR . . . -103.6 121.23 42.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.563 -0.711 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -76.42 -16.6 59.66 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.199 -0.938 . . . . 0.0 110.067 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.636 ' CE1' ' CB ' ' A' ' 5' ' ' ALA . 50.9 p90 -80.23 -46.53 16.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 0.0 109.895 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.629 ' CG ' ' CE2' ' A' ' 7' ' ' TYR . 57.4 mtt180 -49.78 -36.52 26.37 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.59 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -60.68 -37.84 82.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.424 -0.797 . . . . 0.0 109.927 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.94 4.46 55.53 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -82.69 -158.82 25.28 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.511 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 85.4 tt0 -143.41 135.29 26.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -1.171 . . . . 0.0 110.211 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.484 ' C ' ' CD2' ' A' ' 14' ' ' LEU . 89.2 m -83.1 136.26 34.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.159 -0.963 . . . . 0.0 110.119 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.514 ' N ' HD21 ' A' ' 14' ' ' LEU . 3.3 mm? -127.87 134.69 49.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.146 -0.971 . . . . 0.0 110.358 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.534 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 15.2 pt20 -59.98 -24.63 64.6 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.338 -0.851 . . . . 0.0 110.353 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.427 ' O ' ' C ' ' A' ' 17' ' ' CYS . 89.2 mmt-85 -142.65 50.58 1.46 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 109.981 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.427 ' C ' ' O ' ' A' ' 16' ' ' ARG . 12.6 t -42.15 138.85 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.367 -0.833 . . . . 0.0 110.387 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.9 pt -108.62 176.78 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 110.077 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -53.47 -49.1 58.46 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 19' ' ' GLY . 15.7 tp -41.36 -29.87 0.16 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.505 -0.997 . . . . 0.0 110.425 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.96 113.75 26.73 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.279 -0.888 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.478 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 93.0 m-70 -67.83 148.45 51.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.237 -0.914 . . . . 0.0 109.521 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 34' ' ' CYS . 37.0 ttpt -110.6 111.79 23.24 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.173 -0.954 . . . . 0.0 110.786 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.454 HG23 HD11 ' A' ' 24' ' ' ILE . 7.0 mt -71.28 -41.85 74.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.205 -0.934 . . . . 0.0 108.587 178.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.75 -156.26 8.15 Favored Glycine 0 N--CA 1.488 2.153 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 54.5 p -116.5 142.56 46.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.135 -1.215 . . . . 0.0 109.883 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.425 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 72.8 m -87.5 179.96 6.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.946 . . . . 0.0 109.999 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 63.9 t30 -62.48 151.27 37.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.162 -0.961 . . . . 0.0 110.449 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.517 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.4 t80 71.41 -140.46 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.294 -0.879 . . . . 0.0 110.642 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -98.22 3.89 48.9 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.171 -0.956 . . . . 0.0 110.64 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.534 ' CE2' ' HB3' ' A' ' 15' ' ' GLN . 75.9 m-85 -81.24 140.79 34.69 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.093 -1.005 . . . . 0.0 110.431 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 32' ' ' LYS . 11.4 mptt -100.07 161.35 13.66 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.204 -0.935 . . . . 0.0 110.282 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.459 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 84.1 m -99.84 123.82 44.5 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.313 -0.867 . . . . 0.0 109.853 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 23' ' ' LYS . 54.9 m -130.19 163.65 26.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.097 -1.002 . . . . 0.0 110.609 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -127.83 133.4 49.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.252 -0.905 . . . . 0.0 110.424 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -88.8 138.6 31.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.866 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.292 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.231 0.539 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.8 m -119.98 149.19 42.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.245 -0.909 . . . . 0.0 110.306 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.65 -41.51 73.71 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.222 -0.924 . . . . 0.0 110.054 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -142.84 149.37 38.49 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.35 -0.844 . . . . 0.0 109.946 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.93 108.19 11.18 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.12 -0.987 . . . . 0.0 110.529 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.6 t -64.72 -22.88 67.08 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.221 -0.924 . . . . 0.0 109.771 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -62.98 -44.64 95.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.328 -0.857 . . . . 0.0 109.825 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.7 tpp180 -58.35 -41.08 83.9 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.343 -0.848 . . . . 0.0 109.995 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -63.79 -24.19 67.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.317 -0.864 . . . . 0.0 110.159 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.28 8.56 83.37 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.77 177.96 7.64 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.452 ' O ' HD23 ' A' ' 14' ' ' LEU . 41.1 tt0 -116.71 127.41 54.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.182 -1.187 . . . . 0.0 110.07 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.482 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 60.1 m -93.57 119.08 32.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.177 -0.952 . . . . 0.0 110.308 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.587 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.0 mm? -114.74 154.95 27.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.161 -0.962 . . . . 0.0 110.069 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.609 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 30.4 mt-30 -74.22 -17.24 60.91 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.25 -0.906 . . . . 0.0 110.021 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.455 ' O ' ' C ' ' A' ' 17' ' ' CYS . 50.3 mtt180 -152.16 57.17 0.84 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.181 -0.949 . . . . 0.0 110.266 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 72.0 m -37.16 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.573 -0.704 . . . . 0.0 110.447 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 72.3 mt -89.79 171.1 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.247 -0.908 . . . . 0.0 109.759 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -60.05 -45.49 95.85 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 29.0 tp -48.01 -43.64 30.11 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.611 -0.935 . . . . 0.0 110.951 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 66.8 m-85 -72.97 146.82 45.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.304 -0.873 . . . . 0.0 110.944 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.467 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 73.8 m80 -109.93 159.44 17.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.514 -0.741 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.423 ' NZ ' ' O ' ' A' ' 25' ' ' GLY . 60.6 tttm -94.99 108.32 20.38 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.03 -1.044 . . . . 0.0 110.7 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.7 mm -77.28 -42.19 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.885 . . . . 0.0 108.729 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.431 ' C ' HG21 ' A' ' 26' ' ' THR . . . -153.41 -129.28 1.36 Allowed Glycine 0 N--CA 1.486 2.027 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.431 HG21 ' C ' ' A' ' 25' ' ' GLY . 69.5 p -141.39 155.37 45.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.11 -1.23 . . . . 0.0 110.482 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.485 ' SG ' ' HA ' ' A' ' 33' ' ' CYS . 97.4 m -123.16 -167.79 1.66 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.397 -0.814 . . . . 0.0 109.757 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.451 ' C ' ' O ' ' A' ' 27' ' ' CYS . 19.5 m120 -39.57 147.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.607 -0.683 . . . . 0.0 110.169 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.408 ' C ' ' O ' ' A' ' 28' ' ' ASN . 78.7 t80 -42.39 -41.17 2.78 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -0.938 . . . . 0.0 110.792 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -85.24 4.35 35.15 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.114 -0.991 . . . . 0.0 110.853 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.609 ' CE2' ' CG ' ' A' ' 15' ' ' GLN . 96.0 m-85 -139.96 157.03 46.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.071 -1.018 . . . . 0.0 110.66 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 57.5 mttp -127.39 157.64 39.45 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.426 -0.797 . . . . 0.0 109.825 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.485 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 44.5 t -80.93 127.13 32.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.273 -0.892 . . . . 0.0 110.924 -179.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.7 m -141.6 140.32 33.32 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.503 -0.748 . . . . 0.0 109.916 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -136.21 152.7 51.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.15 -0.969 . . . . 0.0 110.329 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.562 ' CE1' ' CZ ' ' A' ' 21' ' ' PHE . 67.5 m-85 -61.73 167.38 3.64 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.303 -0.873 . . . . 0.0 110.015 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.142 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 4' ' ' ARG . 83.7 m-20 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.248 0.547 . . . . 0.0 110.29 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.8 t -49.83 -47.4 51.54 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.16 -0.962 . . . . 0.0 110.182 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -60.3 -29.83 69.08 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.234 -0.916 . . . . 0.0 110.227 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 1' ' ' ASN . 64.1 mtp180 -74.83 161.31 29.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.247 -0.908 . . . . 0.0 109.981 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -113.82 114.35 26.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.149 -0.97 . . . . 0.0 110.462 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.6 m -61.57 -22.25 65.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.774 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -66.71 -44.02 82.76 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.388 -0.82 . . . . 0.0 109.975 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -59.75 -40.63 88.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.409 -0.807 . . . . 0.0 109.97 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' OE2' ' NH2' ' A' ' 4' ' ' ARG . 94.1 mt-10 -67.95 -27.62 66.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.338 -0.851 . . . . 0.0 110.152 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.04 11.07 59.15 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.18 -177.68 9.8 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -125.07 145.69 49.8 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.287 -1.125 . . . . 0.0 110.275 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.457 ' SG ' ' HA ' ' A' ' 33' ' ' CYS . 84.8 m -124.46 131.0 53.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.361 -0.837 . . . . 0.0 110.141 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.3 mt -120.02 146.08 46.21 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -55.66 -28.05 53.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.162 -0.961 . . . . 0.0 108.671 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.465 ' O ' HG13 ' A' ' 18' ' ' ILE . 99.1 mtt180 -135.71 63.58 1.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.435 ' C ' HG13 ' A' ' 18' ' ' ILE . 42.3 t -49.56 116.74 1.88 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.53 -0.731 . . . . 0.0 111.06 -179.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 16' ' ' ARG . 61.5 mt -151.26 172.68 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.414 -0.804 . . . . 0.0 109.499 179.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.463 ' N ' ' CG2' ' A' ' 18' ' ' ILE . . . 92.53 -162.02 26.53 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.4 mt -53.5 -19.96 4.31 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.388 -1.066 . . . . 0.0 110.474 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -75.57 145.45 41.21 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.282 -0.886 . . . . 0.0 110.365 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.414 ' CD2' HG12 ' A' ' 24' ' ' ILE . 35.2 p-80 -121.58 176.79 5.51 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.447 ' HE3' ' HD2' ' A' ' 32' ' ' LYS . 86.4 tttt -103.7 110.86 23.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.449 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.494 HG22 HD11 ' A' ' 24' ' ' ILE . 7.1 mt -88.23 -34.85 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.85 . . . . 0.0 109.069 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.11 -163.25 21.73 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 m -94.15 165.69 12.49 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.026 -1.279 . . . . 0.0 110.614 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.421 ' CB ' ' O ' ' A' ' 31' ' ' PHE . 1.1 t -122.78 -158.55 0.79 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.379 -0.826 . . . . 0.0 110.183 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -71.95 151.75 43.04 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.649 -0.657 . . . . 0.0 110.565 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 8.9 t80 48.3 -124.88 1.83 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.473 -0.767 . . . . 0.0 110.778 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -104.92 14.52 29.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.882 -1.136 . . . . 0.0 111.197 -179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.421 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 60.1 m-85 -84.07 142.55 30.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.012 -1.055 . . . . 0.0 110.189 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HD2' ' HE3' ' A' ' 23' ' ' LYS . 75.2 mmtt -90.07 159.16 16.96 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.28 -0.888 . . . . 0.0 110.65 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.457 ' HA ' ' SG ' ' A' ' 13' ' ' CYS . 16.8 t -89.6 131.81 35.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.309 -0.869 . . . . 0.0 109.985 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.406 ' SG ' ' O ' ' A' ' 22' ' ' HIS . 67.3 m -149.54 137.01 20.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.155 -0.966 . . . . 0.0 110.518 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HB2' HD12 ' A' ' 24' ' ' ILE . 58.7 mtpt -125.96 157.8 36.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.451 -0.78 . . . . 0.0 110.024 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -95.51 132.43 40.62 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.245 -0.909 . . . . 0.0 110.29 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.216 179.932 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.3 m120 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.234 0.54 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 94.2 p -149.86 155.82 40.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.234 -0.916 . . . . 0.0 110.29 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -59.34 157.88 10.23 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.185 -0.947 . . . . 0.0 109.941 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.6 mtp180 -123.35 166.86 14.61 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.182 -0.949 . . . . 0.0 109.995 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.86 112.38 15.93 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 110.437 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 80.5 m -58.52 -23.09 57.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -68.75 -44.04 74.57 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.343 -0.848 . . . . 0.0 110.267 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -65.12 -41.84 94.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -0.928 . . . . 0.0 110.143 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.65 -29.48 68.07 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.158 -0.964 . . . . 0.0 110.093 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.85 3.74 68.0 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -74.47 -169.55 22.21 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 34' ' ' CYS . 87.9 mt-10 -133.2 149.08 52.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -1.091 . . . . 0.0 109.788 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 72.9 m -109.9 129.95 55.59 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.05 -1.031 . . . . 0.0 110.446 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.595 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -118.98 145.65 45.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.355 -0.841 . . . . 0.0 110.191 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -63.13 -29.14 70.56 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.061 -1.024 . . . . 0.0 109.074 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.478 ' O ' ' C ' ' A' ' 17' ' ' CYS . 87.4 mtm180 -138.79 59.49 1.62 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.591 -0.693 . . . . 0.0 109.678 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.478 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.2 t -33.87 132.34 0.24 Allowed 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.5 0.667 . . . . 0.0 111.061 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.426 HG23 ' N ' ' A' ' 19' ' ' GLY . 75.5 mt -91.25 173.65 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.437 -0.789 . . . . 0.0 110.31 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.426 ' N ' HG23 ' A' ' 18' ' ' ILE . . . -59.62 -50.89 62.85 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.442 ' C ' ' CD1' ' A' ' 20' ' ' LEU . 3.3 tm? -44.11 -45.53 8.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.4 -1.059 . . . . 0.0 110.045 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -80.04 135.7 36.41 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.421 -0.799 . . . . 0.0 109.995 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.405 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.5 m-70 -99.43 137.42 37.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.127 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.521 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 85.5 tttt -88.75 119.25 29.06 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.317 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.515 HG13 ' N ' ' A' ' 25' ' ' GLY . 37.4 pt -86.16 -30.35 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.257 -0.902 . . . . 0.0 110.124 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.521 ' O ' ' CE ' ' A' ' 23' ' ' LYS . . . -168.23 -135.64 1.91 Allowed Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -121.22 140.43 52.04 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.239 -1.154 . . . . 0.0 110.523 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.443 ' HB2' ' C ' ' A' ' 32' ' ' LYS . 1.6 t -110.79 -161.6 0.76 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 27' ' ' CYS . 83.5 m-20 -46.23 141.99 3.12 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 119.693 -0.803 . . . . 0.0 109.447 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.98 -21.36 0.13 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.075 -1.015 . . . . 0.0 110.797 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 16.2 tpt180 -93.24 -3.64 53.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.003 -1.061 . . . . 0.0 110.424 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -148.11 157.01 43.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.854 -1.154 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 73.3 mmtt -101.88 158.34 16.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.365 -0.834 . . . . 0.0 109.69 179.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.511 ' SG ' ' CG1' ' A' ' 24' ' ' ILE . 7.0 t -85.85 115.07 23.27 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.143 -0.973 . . . . 0.0 110.421 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.491 ' O ' ' N ' ' A' ' 12' ' ' GLU . 85.0 m -131.96 142.57 49.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.356 -0.84 . . . . 0.0 110.07 179.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -123.72 129.1 50.57 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.989 . . . . 0.0 110.371 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -80.71 139.93 35.86 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.917 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.113 179.906 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . 0.442 ' O ' ' O ' ' A' ' 4' ' ' ARG . 82.9 m-20 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 121.321 0.581 . . . . 0.0 110.089 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 99.3 p -64.67 -29.08 70.07 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.352 -0.842 . . . . 0.0 110.361 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -66.94 -30.18 70.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.182 -0.949 . . . . 0.0 110.242 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.442 ' O ' ' O ' ' A' ' 1' ' ' ASN . 26.9 ptt-85 -144.85 141.1 28.83 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.308 -0.87 . . . . 0.0 110.03 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -112.28 110.63 20.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.293 -0.88 . . . . 0.0 110.424 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.5 t -59.54 -23.08 62.56 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.222 -0.924 . . . . 0.0 109.943 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -70.37 -40.18 74.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.257 -0.902 . . . . 0.0 110.004 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -66.63 -33.45 75.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.306 -0.871 . . . . 0.0 109.875 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -65.34 -34.54 78.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 19.78 78.09 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.61 -152.3 7.16 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -121.06 146.85 46.28 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -1.192 . . . . 0.0 109.836 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.582 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 74.2 m -121.73 116.4 24.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.967 . . . . 0.0 110.367 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.59 ' CD2' ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -120.93 147.32 45.6 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.321 -0.862 . . . . 0.0 109.764 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.454 ' OE1' ' HA ' ' A' ' 31' ' ' PHE . 16.2 mm-40 -54.78 -21.42 11.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.98 -1.075 . . . . 0.0 109.347 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -169.34 71.76 0.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.583 -0.698 . . . . 0.0 109.701 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.483 ' O ' HG21 ' A' ' 18' ' ' ILE . 28.7 p -63.99 145.29 56.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.0 110.741 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.483 HG21 ' O ' ' A' ' 17' ' ' CYS . 32.5 pt -141.1 159.23 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.641 -0.662 . . . . 0.0 110.153 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.57 -145.81 17.33 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.498 ' O ' ' CD2' ' A' ' 22' ' ' HIS . 26.3 mt -61.85 -16.18 48.2 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.399 -1.06 . . . . 0.0 110.228 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -72.59 135.34 45.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.339 -0.85 . . . . 0.0 111.028 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.498 ' CD2' ' O ' ' A' ' 20' ' ' LEU . 94.6 m-70 -121.53 151.76 39.95 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.412 -0.805 . . . . 0.0 109.016 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 60.2 tttm -93.54 126.64 38.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.868 -1.145 . . . . 0.0 111.66 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mt -101.49 -37.17 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.46 -148.59 5.17 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 43.5 p -136.31 149.0 48.23 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.072 -1.252 . . . . 0.0 110.469 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 8.1 m -115.69 163.91 15.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.355 -0.841 . . . . 0.0 109.732 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.52 ' O ' ' N ' ' A' ' 30' ' ' ARG . 54.8 t-20 38.98 29.72 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.432 -0.792 . . . . 0.0 110.692 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.478 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 85.1 t80 60.34 -74.75 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.437 -0.789 . . . . 0.0 110.509 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 28' ' ' ASN . 81.6 mtt180 -58.39 -49.35 77.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.2 -0.938 . . . . 0.0 110.513 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.454 ' HA ' ' OE1' ' A' ' 15' ' ' GLN . 90.5 m-85 -71.05 158.47 36.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.19 -0.943 . . . . 0.0 110.516 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 71.3 mmtt -108.58 168.35 9.4 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.465 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.0 t -107.0 133.87 51.0 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.185 -0.947 . . . . 0.0 109.787 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 96.1 m -140.52 134.69 30.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.453 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -110.79 148.65 31.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.354 -0.841 . . . . 0.0 110.401 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -81.87 145.21 30.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.223 -0.923 . . . . 0.0 109.925 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.489 ' OE1' ' CD2' ' A' ' 22' ' ' HIS . 61.6 tt0 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.263 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.247 0.546 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.6 m -64.23 -37.53 87.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.314 -0.866 . . . . 0.0 110.324 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -117.29 137.63 52.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.124 -0.985 . . . . 0.0 110.481 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.452 ' HD3' ' OE2' ' A' ' 9' ' ' GLU . 26.5 ttm180 -112.84 153.32 28.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.425 -0.797 . . . . 0.0 109.831 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.427 ' HB2' ' HD2' ' A' ' 8' ' ' ARG . . . -120.3 105.55 11.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.926 . . . . 0.0 110.212 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.9 t -52.75 -27.2 16.78 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -69.69 -33.68 72.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.363 -0.836 . . . . 0.0 110.129 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.427 ' HD2' ' HB2' ' A' ' 5' ' ' ALA . 79.8 mtt85 -73.95 -29.74 62.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.2 -0.938 . . . . 0.0 109.924 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.452 ' OE2' ' HD3' ' A' ' 4' ' ' ARG . 43.7 mt-10 -69.29 -24.42 63.95 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.72 4.52 36.71 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.408 ' CA ' ' HG2' ' A' ' 35' ' ' LYS . . . -86.78 -173.9 49.05 Favored Glycine 0 N--CA 1.49 2.233 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -124.96 142.8 51.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.21 -1.171 . . . . 0.0 110.224 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 48.0 m -92.99 133.14 36.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.272 -0.892 . . . . 0.0 110.185 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.467 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 2.9 mm? -130.8 142.45 50.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.222 -0.924 . . . . 0.0 110.142 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.455 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 89.0 mt-30 -74.27 -21.68 59.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.294 -0.879 . . . . 0.0 110.569 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.424 ' O ' ' C ' ' A' ' 17' ' ' CYS . 92.1 mtt180 -148.83 62.01 1.06 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.108 -0.995 . . . . 0.0 110.639 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 92.5 m -41.86 144.18 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.159 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.429 ' CG1' ' H ' ' A' ' 19' ' ' GLY . 16.8 tt -119.5 176.73 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.168 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.429 ' H ' ' CG1' ' A' ' 18' ' ' ILE . . . -48.08 -45.21 26.68 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 99.5 mt -52.68 -29.47 26.75 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.608 -0.936 . . . . 0.0 110.652 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.484 ' CE2' ' HB2' ' A' ' 36' ' ' PHE . 87.9 m-85 -113.38 146.06 40.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.126 -0.984 . . . . 0.0 110.542 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.419 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.1 m-70 -106.87 134.12 50.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.736 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.489 ' CD ' ' HD2' ' A' ' 32' ' ' LYS . 39.0 ttpt -92.92 97.65 10.87 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.117 -0.989 . . . . 0.0 110.617 -179.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.516 ' CG2' ' SG ' ' A' ' 33' ' ' CYS . 18.9 tt -64.41 -43.39 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.161 -0.962 . . . . 0.0 109.832 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.46 ' N ' ' CG2' ' A' ' 24' ' ' ILE . . . -155.17 -148.11 4.91 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.4 p -120.99 150.11 41.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.251 -1.147 . . . . 0.0 110.133 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 32' ' ' LYS . 92.4 m -77.68 -169.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 110.423 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.435 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 81.0 m-20 -51.71 -39.75 58.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.215 -0.928 . . . . 0.0 110.481 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.538 ' CD2' ' HB2' ' A' ' 30' ' ' ARG . 60.0 t80 -179.32 150.59 0.44 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.49 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.538 ' HB2' ' CD2' ' A' ' 29' ' ' PHE . 68.2 ttt180 66.16 -59.15 0.33 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.437 -0.789 . . . . 0.0 111.127 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.455 ' N ' ' O ' ' A' ' 29' ' ' PHE . 96.6 m-85 -79.48 157.12 27.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 0.0 110.647 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.489 ' HD2' ' CD ' ' A' ' 23' ' ' LYS . 50.3 mtmt -110.14 158.33 18.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.484 -0.76 . . . . 0.0 109.989 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.516 ' SG ' ' CG2' ' A' ' 24' ' ' ILE . 37.7 t -86.89 118.21 26.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.185 -0.947 . . . . 0.0 110.464 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 23' ' ' LYS . 55.6 m -138.71 132.4 30.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.367 -0.833 . . . . 0.0 110.024 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HG2' ' CA ' ' A' ' 11' ' ' GLY . 98.6 mttt -113.37 139.81 48.57 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.295 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.484 ' HB2' ' CE2' ' A' ' 21' ' ' PHE . 91.2 t80 -108.13 142.89 37.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.324 -0.86 . . . . 0.0 110.149 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.192 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 58.9 t30 . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.204 0.526 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.0 p -70.79 -36.87 73.21 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.328 -0.857 . . . . 0.0 110.099 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -137.41 160.89 37.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.209 -0.932 . . . . 0.0 109.968 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -84.66 158.65 20.76 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.24 -0.913 . . . . 0.0 110.334 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.71 115.28 27.65 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.289 -0.882 . . . . 0.0 110.038 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.523 ' CA ' ' HA2' ' A' ' 10' ' ' GLY . 59.5 m -71.9 -15.86 62.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -73.26 -29.64 62.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.293 -0.879 . . . . 0.0 110.444 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -83.89 -45.42 13.23 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.396 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -135.23 0.78 2.86 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.208 -0.932 . . . . 0.0 110.617 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.523 ' HA2' ' CA ' ' A' ' 6' ' ' CYS . . . -56.9 -23.2 44.63 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 72.15 -99.25 0.86 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -136.78 159.11 42.83 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -1.177 . . . . 0.0 110.303 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.453 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 57.7 m -120.24 150.04 41.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.21 -0.931 . . . . 0.0 110.655 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.453 HD22 ' O ' ' A' ' 16' ' ' ARG . 4.7 tp -148.45 160.28 43.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.351 -0.843 . . . . 0.0 109.872 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -69.22 -52.16 30.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.544 -0.723 . . . . 0.0 110.064 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.453 ' O ' HD22 ' A' ' 14' ' ' LEU . 40.6 mmt180 -106.61 80.64 1.49 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.329 -0.857 . . . . 0.0 110.022 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.447 ' O ' HD11 ' A' ' 18' ' ' ILE . 7.2 t -77.11 81.07 3.63 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.447 HD11 ' O ' ' A' ' 17' ' ' CYS . 18.7 mm -136.85 166.84 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 110.487 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 86.66 -128.06 8.7 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 23.7 tp -67.97 -32.17 72.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -1.141 . . . . 0.0 110.813 -179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 36' ' ' PHE . 90.7 m-85 -80.44 132.65 35.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.204 -0.935 . . . . 0.0 110.415 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -107.11 141.67 37.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.299 -0.875 . . . . 0.0 109.889 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.46 ' CD ' ' HD3' ' A' ' 32' ' ' LYS . 21.0 ttpt -89.42 114.01 25.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.142 -0.974 . . . . 0.0 110.473 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.498 HG22 HD11 ' A' ' 24' ' ' ILE . 22.7 mm -77.74 -41.89 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.309 -0.869 . . . . 0.0 108.761 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.419 ' C ' HG21 ' A' ' 26' ' ' THR . . . -164.12 -129.28 1.02 Allowed Glycine 0 N--CA 1.486 2.023 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.419 HG21 ' C ' ' A' ' 25' ' ' GLY . 38.8 p -127.13 150.4 49.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.167 -1.196 . . . . 0.0 109.855 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.434 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -84.67 -160.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -0.997 . . . . 0.0 111.021 -179.62 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -62.48 -42.98 99.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.86 -0.525 . . . . 0.0 110.963 -179.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.565 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 81.7 t80 -177.08 143.98 0.42 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.17 -0.956 . . . . 0.0 110.543 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.538 ' O ' ' CD1' ' A' ' 31' ' ' PHE . 12.0 tpp180 52.33 19.63 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.284 -0.885 . . . . 0.0 110.255 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.565 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 47.9 m-85 -149.62 154.63 38.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 0.0 110.044 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.46 ' HD3' ' CD ' ' A' ' 23' ' ' LYS . 62.8 mttp -112.5 158.1 20.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.233 -0.917 . . . . 0.0 110.455 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.0 t -85.21 124.5 31.93 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.315 -0.866 . . . . 0.0 109.838 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 65.3 m -135.54 141.59 45.25 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.181 -0.95 . . . . 0.0 110.531 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -116.59 127.31 54.37 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.31 -0.869 . . . . 0.0 109.909 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.401 ' CD1' ' CE1' ' A' ' 21' ' ' PHE . 92.2 t80 -98.41 139.72 33.74 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.173 -0.954 . . . . 0.0 110.562 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.085 179.747 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 9.8 m120 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.274 0.559 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.418 ' O ' ' CD ' ' A' ' 9' ' ' GLU . 86.1 p -141.35 152.32 44.28 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.158 -0.964 . . . . 0.0 110.125 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 54.5 mttm -59.8 -38.02 80.77 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.23 -0.919 . . . . 0.0 110.333 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.8 158.28 25.37 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.264 -0.898 . . . . 0.0 110.187 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.623 ' CB ' ' CE2' ' A' ' 7' ' ' TYR . . . 54.67 95.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.308 -0.87 . . . . 0.0 109.767 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -74.73 -21.2 59.49 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.432 -0.792 . . . . 0.0 110.02 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.63 ' CD1' ' N ' ' A' ' 8' ' ' ARG . 53.2 p90 -69.31 -44.73 71.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.413 -0.804 . . . . 0.0 109.647 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.63 ' N ' ' CD1' ' A' ' 7' ' ' TYR . 38.9 ttm180 -57.68 -42.66 84.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.37 -0.831 . . . . 0.0 109.906 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.418 ' CD ' ' O ' ' A' ' 2' ' ' SER . 41.6 mt-10 -67.02 -29.68 69.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.068 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.16 9.56 61.94 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.15 176.68 26.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -132.21 146.47 52.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.246 -1.15 . . . . 0.0 110.326 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 79.1 m -103.57 130.76 51.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.255 -0.903 . . . . 0.0 109.95 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.0 mt -112.32 141.58 45.87 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.148 -0.97 . . . . 0.0 110.499 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -56.64 -24.74 50.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 0.0 109.665 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.415 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.9 mtt-85 -137.91 55.12 1.78 Allowed 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.6 t -39.81 130.71 1.94 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.528 -0.733 . . . . 0.0 110.725 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.7 mm -100.23 171.03 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.473 -0.767 . . . . 0.0 110.203 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.403 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -59.09 -46.41 93.8 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.403 ' C ' ' O ' ' A' ' 19' ' ' GLY . 34.0 tp -42.1 -37.92 1.54 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.607 -0.937 . . . . 0.0 110.179 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.422 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 88.4 m-85 -89.22 113.55 24.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.357 -0.839 . . . . 0.0 110.433 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.458 ' O ' ' N ' ' A' ' 35' ' ' LYS . 85.3 t60 -62.53 138.84 58.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.284 -0.885 . . . . 0.0 109.834 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -99.54 112.13 24.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 110.451 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 15.1 mt -72.63 -39.61 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.289 -0.882 . . . . 0.0 108.658 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -174.56 -129.7 1.21 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.8 p -120.22 155.8 32.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.209 -1.171 . . . . 0.0 110.028 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' PHE . 0.6 OUTLIER -94.59 -159.38 0.7 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -0.999 . . . . 0.0 110.438 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.449 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 43.9 t30 -43.09 -53.12 5.08 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.699 -0.625 . . . . 0.0 110.222 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 58.7 t80 -178.66 -61.84 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.49 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -68.8 -34.63 75.85 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.27 -0.894 . . . . 0.0 110.98 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.495 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 91.2 m-85 -103.51 156.11 18.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.018 -1.051 . . . . 0.0 110.591 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -102.7 159.25 15.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.389 -0.819 . . . . 0.0 109.936 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.2 t -82.88 127.97 33.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.24 -0.913 . . . . 0.0 110.122 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 57.5 m -134.01 152.86 52.02 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.148 -0.97 . . . . 0.0 110.404 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.458 ' N ' ' O ' ' A' ' 22' ' ' HIS . 52.9 tttp -127.62 119.77 26.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.357 -0.839 . . . . 0.0 110.156 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -77.22 141.38 40.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.245 -0.91 . . . . 0.0 110.264 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.441 ' CG ' ' OXT' ' A' ' 37' ' ' GLN . 3.6 tt0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 117.934 -1.032 . . . . 0.0 110.167 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.213 0.53 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.95 -24.42 67.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.93 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -66.55 -43.86 83.94 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.888 . . . . 0.0 110.018 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -63.31 -35.22 79.65 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.295 -0.878 . . . . 0.0 109.981 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -66.19 -31.02 71.6 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 110.148 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.61 32.75 29.65 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.14 -172.01 48.5 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -117.76 147.69 42.75 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.268 -1.136 . . . . 0.0 110.294 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.714 ' C ' HD22 ' A' ' 14' ' ' LEU . 16.1 m -99.08 120.24 39.15 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.747 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -116.11 138.19 51.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.126 -0.984 . . . . 0.0 110.402 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.53 ' HG2' ' CE1' ' A' ' 31' ' ' PHE . 74.1 mt-30 -65.52 -27.51 68.52 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.347 -0.846 . . . . 0.0 109.915 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.7 mtm180 -141.33 58.49 1.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.413 -0.805 . . . . 0.0 110.101 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.442 ' C ' ' O ' ' A' ' 16' ' ' ARG . 19.1 t -38.58 124.57 1.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.482 -0.761 . . . . 0.0 110.823 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.581 HG22 ' N ' ' A' ' 19' ' ' GLY . 72.0 mt -91.59 173.93 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.051 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.581 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -56.88 -48.7 76.59 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.753 HD13 ' O ' ' A' ' 20' ' ' LEU . 3.1 tm? -40.81 -40.8 1.43 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.541 -0.976 . . . . 0.0 110.439 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 93.4 m-85 -88.39 118.71 28.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.43 -0.794 . . . . 0.0 110.497 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.487 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 97.2 m-70 -67.59 150.07 49.26 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.132 -0.98 . . . . 0.0 109.507 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -105.28 125.55 51.11 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.041 -1.037 . . . . 0.0 111.026 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.0 mm -100.76 -37.53 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 CA-C-O 121.737 0.78 . . . . 0.0 109.021 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -171.83 -150.42 7.17 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.325 -1.51 . . . . 0.0 109.325 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.2 p -119.15 160.2 22.55 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -1.219 . . . . 0.0 110.345 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 86.4 m -87.1 -164.92 1.16 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.219 -0.925 . . . . 0.0 110.627 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -64.92 -42.18 94.91 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.552 -0.718 . . . . 0.0 110.861 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.64 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 66.8 t80 -175.09 140.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -0.924 . . . . 0.0 110.473 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.64 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 38.4 mmt180 57.47 20.68 6.26 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.392 -0.818 . . . . 0.0 110.449 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.53 ' CE1' ' HG2' ' A' ' 15' ' ' GLN . 43.7 m-85 -148.12 152.43 37.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.187 -0.946 . . . . 0.0 110.113 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 27' ' ' CYS . 92.9 mttt -117.81 158.07 25.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.174 -0.954 . . . . 0.0 109.921 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.3 t -94.81 119.34 33.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 87.0 m -136.37 165.12 26.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.387 -0.821 . . . . 0.0 110.063 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -127.83 141.66 51.51 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -106.59 139.14 41.51 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.312 -0.867 . . . . 0.0 110.058 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.273 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.55 ' HB3' ' HE ' ' A' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.226 0.536 . . . . 0.0 110.45 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.5 t -59.39 -25.78 64.57 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.182 -0.948 . . . . 0.0 109.899 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -63.58 -41.89 98.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.295 -0.878 . . . . 0.0 110.114 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.55 ' HE ' ' HB3' ' A' ' 5' ' ' ALA . 53.6 mtm180 -75.17 -33.27 61.45 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.318 -0.864 . . . . 0.0 110.261 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -65.77 -25.78 67.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.317 -0.864 . . . . 0.0 110.116 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.96 12.83 73.3 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.2 165.21 13.01 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.423 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 68.4 mm-40 -100.92 141.61 33.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.302 -1.117 . . . . 0.0 110.255 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.7 m -100.19 129.87 46.26 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.168 -0.957 . . . . 0.0 110.436 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 14' ' ' LEU . 13.2 tp -124.44 166.67 15.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.085 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -79.23 -30.91 43.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.177 -0.952 . . . . 0.0 109.777 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 17' ' ' CYS . 34.0 ttm180 -146.66 76.33 1.43 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.0 109.312 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.437 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.8 t -36.08 126.07 0.75 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.431 0.634 . . . . 0.0 111.057 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.1 pt -95.95 178.82 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.338 -0.851 . . . . 0.0 110.253 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' A' ' 20' ' ' LEU . . . -56.9 -175.57 0.29 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 19' ' ' GLY . 60.0 mt 61.13 11.42 3.46 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -1.087 . . . . 0.0 110.332 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -135.78 131.0 34.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.0 110.505 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -99.34 142.09 31.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.421 -0.8 . . . . 0.0 109.481 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 84.7 tttt -95.72 112.04 23.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.055 -1.028 . . . . 0.0 111.166 -179.145 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.407 HD13 HG21 ' A' ' 24' ' ' ILE . 5.6 mt -87.99 -34.23 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.305 -0.872 . . . . 0.0 108.737 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.76 -156.68 8.33 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.5 p -123.61 156.33 36.0 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.198 -1.178 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.473 ' HB2' ' HB2' ' A' ' 31' ' ' PHE . 83.6 m -74.94 -166.7 0.5 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.375 -0.828 . . . . 0.0 110.427 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 47.4 t30 -71.64 -35.7 70.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.605 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.574 ' CE2' ' HG3' ' A' ' 30' ' ' ARG . 54.2 t80 179.64 144.96 0.18 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 110.141 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HG3' ' CE2' ' A' ' 29' ' ' PHE . 95.3 mtt180 57.18 19.01 4.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.408 -0.807 . . . . 0.0 110.972 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.473 ' HB2' ' HB2' ' A' ' 27' ' ' CYS . 44.1 m-85 -150.48 158.93 44.71 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.899 -1.125 . . . . 0.0 110.655 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.421 ' C ' ' SG ' ' A' ' 27' ' ' CYS . 35.6 mmtp -126.45 159.11 34.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.324 -0.86 . . . . 0.0 109.938 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 36.4 t -88.22 125.98 34.91 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.194 -0.941 . . . . 0.0 110.166 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 70.1 m -120.28 137.11 54.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 109.928 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -121.41 131.51 54.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.117 -0.99 . . . . 0.0 110.374 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 37' ' ' GLN . 62.2 t80 -103.45 128.17 50.67 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.473 ' HB3' ' O ' ' A' ' 36' ' ' PHE . 52.5 tt0 . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.271 0.558 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.1 t -63.19 -21.02 65.94 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.231 -0.918 . . . . 0.0 110.062 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -70.48 -37.38 74.24 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.924 . . . . 0.0 109.747 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttp85 -63.75 -37.18 86.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.482 -0.761 . . . . 0.0 109.946 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.508 ' CD ' HD12 ' A' ' 24' ' ' ILE . 52.1 mt-10 -69.06 -33.6 73.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.082 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.25 14.87 79.72 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.92 161.83 49.1 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.361 -1.496 . . . . 0.0 109.361 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.525 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 76.3 tt0 -101.97 139.95 36.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -1.202 . . . . 0.0 110.392 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.88 ' C ' HD22 ' A' ' 14' ' ' LEU . 67.6 m -84.71 130.87 34.64 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.36 -0.838 . . . . 0.0 110.13 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.88 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.0 mm? -124.54 135.32 53.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 110.3 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.0 tp60 -62.99 -30.65 71.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.239 -0.913 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 17' ' ' CYS . 70.2 mtm180 -139.92 58.97 1.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.372 -0.83 . . . . 0.0 109.761 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.439 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.1 t -40.03 137.91 0.9 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.448 -0.783 . . . . 0.0 110.616 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 46.6 pt -114.14 179.53 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.363 -0.836 . . . . 0.0 110.499 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -54.5 -48.9 62.93 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 20' ' ' LEU . 15.5 tp -40.69 -41.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.649 -0.912 . . . . 0.0 110.45 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.488 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 90.1 m-85 -98.31 137.07 37.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.437 -0.789 . . . . 0.0 110.155 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -97.88 126.05 43.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.191 -0.943 . . . . 0.0 109.974 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.95 127.3 32.11 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.229 -0.919 . . . . 0.0 110.756 -179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.6 HG21 ' HB2' ' A' ' 35' ' ' LYS . 46.3 pt -103.44 -13.28 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.345 -0.847 . . . . 0.0 109.745 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.84 -136.78 3.74 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 3.1 m -138.16 157.61 45.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.097 -1.237 . . . . 0.0 110.227 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.448 ' O ' ' C ' ' A' ' 28' ' ' ASN . 72.8 m -93.7 -161.08 0.81 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.408 -0.808 . . . . 0.0 109.857 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.493 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.9 t30 -41.11 -46.56 3.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.521 -0.737 . . . . 0.0 110.149 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.493 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 92.3 t80 178.95 -63.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.397 -0.814 . . . . 0.0 110.816 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -61.99 -40.81 96.91 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.339 -0.85 . . . . 0.0 111.38 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.446 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 97.4 m-85 -96.01 164.27 12.78 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.067 -1.021 . . . . 0.0 111.492 -178.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.455 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 59.3 mttp -116.4 160.53 20.42 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.657 -0.652 . . . . 0.0 109.318 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 26' ' ' THR . 67.4 m -92.35 121.45 33.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.946 -1.096 . . . . 0.0 110.673 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.54 ' HB2' HD23 ' A' ' 14' ' ' LEU . 68.8 m -127.85 136.81 51.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.442 -0.786 . . . . 0.0 109.865 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.6 ' HB2' HG21 ' A' ' 24' ' ' ILE . 81.6 tttt -115.49 133.74 55.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.427 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -99.97 141.97 32.08 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.153 179.818 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.245 0.545 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.2 t -60.02 -23.26 63.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.959 . . . . 0.0 109.841 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -65.18 -37.7 88.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -62.53 -37.65 86.92 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.3 -0.875 . . . . 0.0 109.917 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.48 17.96 72.24 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -177.6 43.25 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -105.86 135.05 48.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.28 -1.13 . . . . 0.0 110.102 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.903 ' C ' HD22 ' A' ' 14' ' ' LEU . 87.9 m -92.91 130.52 38.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 110.239 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.903 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.2 mm? -132.09 143.64 50.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.386 -0.821 . . . . 0.0 110.119 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.539 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 11.2 pt20 -63.2 -33.22 75.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.213 -0.929 . . . . 0.0 109.428 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' A' ' 15' ' ' GLN . 78.8 mtt85 -158.4 61.97 0.44 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.601 -0.687 . . . . 0.0 109.714 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.598 ' O ' HG23 ' A' ' 18' ' ' ILE . 22.2 p -60.52 146.88 43.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.19 -0.944 . . . . 0.0 110.494 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.598 HG23 ' O ' ' A' ' 17' ' ' CYS . 29.5 pt -158.82 158.25 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.433 -0.792 . . . . 0.0 110.454 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.57 -119.75 4.98 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.6 mt -61.94 -23.16 66.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.31 -1.112 . . . . 0.0 110.554 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.438 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 80.0 m-85 -103.73 129.16 51.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.133 -0.98 . . . . 0.0 111.042 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -119.27 139.44 51.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.387 -0.82 . . . . 0.0 109.174 179.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -74.27 123.04 23.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.028 -1.045 . . . . 0.0 111.132 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.516 HG13 ' CG ' ' A' ' 35' ' ' LYS . 14.6 mm -93.38 -37.47 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -156.42 -143.49 3.68 Favored Glycine 0 N--CA 1.487 2.059 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 27.6 p -127.78 164.49 22.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.127 -1.219 . . . . 0.0 110.466 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.7 m -123.31 -176.96 3.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.243 -0.91 . . . . 0.0 110.125 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.512 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 51.6 t-20 -60.03 146.17 43.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 110.157 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.5 t80 70.98 -150.97 0.09 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.305 -0.872 . . . . 0.0 110.417 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -87.71 -5.4 58.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.255 -0.903 . . . . 0.0 110.732 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -72.09 138.9 48.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.183 -0.948 . . . . 0.0 110.234 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 94.2 mttt -103.18 164.93 11.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 13' ' ' CYS . 23.8 m -93.97 134.83 35.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 110.369 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.459 ' HB2' HD23 ' A' ' 14' ' ' LEU . 78.2 m -138.97 134.68 33.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.255 -0.903 . . . . 0.0 109.98 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.516 ' CG ' HG13 ' A' ' 24' ' ' ILE . 98.7 mttt -113.94 143.32 44.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.136 -0.978 . . . . 0.0 110.294 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 138.45 51.68 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 110.15 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.251 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.473 0.654 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.9 m -54.55 -34.76 62.38 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.389 -0.82 . . . . 0.0 109.646 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -61.08 -42.63 98.86 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.519 -0.738 . . . . 0.0 109.847 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttt-85 -63.69 -35.49 80.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.44 -0.788 . . . . 0.0 110.235 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -71.39 -21.21 62.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 110.252 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.24 19.34 33.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -165.37 40.33 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 39.5 tp10 -135.88 148.49 48.64 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.242 -1.151 . . . . 0.0 110.178 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.774 ' C ' HD22 ' A' ' 14' ' ' LEU . 67.1 m -111.27 121.04 44.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.229 -0.919 . . . . 0.0 110.374 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.784 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -119.8 150.57 40.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.232 -0.918 . . . . 0.0 110.091 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -62.38 -35.2 78.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 0.0 109.699 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.772 ' O ' HG23 ' A' ' 18' ' ' ILE . 57.6 mtp180 -141.96 58.76 1.48 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.422 -0.799 . . . . 0.0 109.723 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 2.0 t -50.73 121.59 6.09 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.333 -0.855 . . . . 0.0 110.57 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.772 HG23 ' O ' ' A' ' 16' ' ' ARG . 25.9 pt -140.9 164.92 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.46 -0.775 . . . . 0.0 110.036 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.05 -151.71 17.61 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.5 mt -59.48 -17.99 36.16 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -1.167 . . . . 0.0 110.02 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -68.91 140.49 55.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.402 -0.811 . . . . 0.0 110.91 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 89.2 m-70 -114.63 162.51 16.68 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.316 -0.865 . . . . 0.0 109.413 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -91.48 111.96 23.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.929 -1.107 . . . . 0.0 110.848 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.4 mm -87.86 -35.19 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.06 -148.79 5.83 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 25.0 p -129.53 152.19 49.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.311 -1.111 . . . . 0.0 110.007 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.566 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 80.1 m -106.14 -174.75 2.61 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.109 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.522 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 93.3 m-20 -99.37 160.88 13.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.292 -0.88 . . . . 0.0 110.428 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.601 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 1.5 t80 71.16 39.03 1.0 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.28 -0.887 . . . . 0.0 110.271 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 95.5 mtt180 62.52 62.36 1.13 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 110.415 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.601 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 42.3 m-85 -145.68 155.06 42.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.218 -0.926 . . . . 0.0 110.055 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 48.2 mtmt -113.95 166.95 11.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.15 -0.969 . . . . 0.0 110.338 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.8 t -108.94 128.23 54.75 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 19.5 p -153.08 145.32 23.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.277 -0.889 . . . . 0.0 110.019 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -124.32 156.34 37.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.483 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -79.84 139.88 37.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.356 -0.84 . . . . 0.0 110.02 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.221 -179.802 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.469 ' HB3' ' HD2' ' A' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.425 0.631 . . . . 0.0 110.264 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.2 t -70.76 -28.57 64.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -59.7 -39.53 84.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.469 ' HD2' ' HB3' ' A' ' 5' ' ' ALA . 85.6 mtt180 -60.55 -42.27 96.21 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.314 -0.866 . . . . 0.0 110.116 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.295 -0.878 . . . . 0.0 110.019 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.38 -3.3 85.36 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.37 174.4 7.86 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 94.4 mt-10 -113.15 137.07 52.0 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.246 -1.15 . . . . 0.0 110.353 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.929 ' C ' HD22 ' A' ' 14' ' ' LEU . 15.7 m -85.39 124.09 31.59 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.28 -0.888 . . . . 0.0 109.99 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.929 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.3 mm? -124.57 146.15 49.2 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.13 -0.981 . . . . 0.0 110.161 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -63.74 -37.06 85.95 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.26 -0.9 . . . . 0.0 109.99 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 18' ' ' ILE . 37.2 ptt180 -137.01 58.12 1.73 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.23 -0.919 . . . . 0.0 109.607 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.577 ' C ' HG23 ' A' ' 18' ' ' ILE . 53.8 t -51.73 122.85 8.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.474 -0.766 . . . . 0.0 110.837 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.577 HG23 ' C ' ' A' ' 17' ' ' CYS . 19.4 pt -158.32 163.71 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.306 -0.871 . . . . 0.0 110.104 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.02 -145.62 16.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.73 -29.99 71.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.299 -1.118 . . . . 0.0 110.633 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 36' ' ' PHE . 95.5 m-85 -60.83 135.2 57.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.925 . . . . 0.0 110.422 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.46 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 98.0 m-70 -104.76 128.98 53.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.284 -0.885 . . . . 0.0 109.596 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.6 ttpt -81.32 115.76 20.84 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.144 -0.972 . . . . 0.0 110.828 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.668 HD11 ' HB2' ' A' ' 35' ' ' LYS . 11.1 mt -77.24 -47.4 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 108.868 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.41 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -158.79 -168.38 20.82 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.432 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 0.9 OUTLIER -94.08 158.33 15.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.071 -1.252 . . . . 0.0 110.154 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.547 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 57.4 m -85.07 -163.7 0.88 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.207 -0.933 . . . . 0.0 110.668 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 68.7 m-20 -63.18 -33.01 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 111.197 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.643 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 72.7 t80 -179.62 140.19 0.14 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.022 -1.049 . . . . 0.0 110.878 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.643 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 27.2 mmt85 49.03 25.4 1.09 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.277 -0.889 . . . . 0.0 110.658 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.547 ' CB ' ' HB2' ' A' ' 27' ' ' CYS . 33.6 m-85 -147.45 152.17 37.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.172 -0.955 . . . . 0.0 110.258 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.465 ' HE3' ' HB3' ' A' ' 17' ' ' CYS . 52.4 mtmt -115.41 155.31 27.65 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.931 . . . . 0.0 110.181 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 18.0 t -98.91 125.23 44.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.427 -0.795 . . . . 0.0 110.327 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.2 m -132.63 163.88 27.93 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.279 -0.888 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.668 ' HB2' HD11 ' A' ' 24' ' ' ILE . 87.8 tttt -131.93 140.56 49.06 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.365 -0.834 . . . . 0.0 109.97 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.563 ' HB3' ' CE1' ' A' ' 21' ' ' PHE . 44.6 p90 -123.64 161.43 25.06 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 110.256 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.409 -179.911 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.318 0.58 . . . . 0.0 109.92 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.81 -25.57 68.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.391 -0.818 . . . . 0.0 110.194 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -64.24 -38.93 92.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.357 -0.84 . . . . 0.0 110.078 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -57.82 -34.71 69.95 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.2 -0.937 . . . . 0.0 110.037 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -58.75 -29.23 66.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.235 -0.916 . . . . 0.0 110.109 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.85 10.76 34.2 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.54 -176.81 16.16 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.2 tp10 -110.01 130.28 55.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.258 -1.143 . . . . 0.0 109.952 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.914 ' C ' HD22 ' A' ' 14' ' ' LEU . 96.7 m -106.32 134.0 50.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.304 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.914 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.4 mm? -120.75 151.4 39.61 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.361 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -67.85 -24.91 65.31 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.373 -0.829 . . . . 0.0 109.619 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.451 ' O ' ' C ' ' A' ' 17' ' ' CYS . 81.3 mtm180 -145.71 59.23 1.26 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.454 -0.779 . . . . 0.0 109.897 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.451 ' C ' ' O ' ' A' ' 16' ' ' ARG . 38.4 t -36.24 122.08 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.572 -0.705 . . . . 0.0 110.555 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.471 HG22 ' N ' ' A' ' 19' ' ' GLY . 48.6 mt -77.13 170.77 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.398 -0.814 . . . . 0.0 110.152 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.471 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -58.93 -49.36 79.12 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.284 -1.527 . . . . 0.0 109.284 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 20' ' ' LEU . 16.6 tp -42.96 -40.05 2.84 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.439 -1.036 . . . . 0.0 110.231 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.455 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 68.9 m-85 -82.33 140.27 33.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.353 -0.842 . . . . 0.0 110.219 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.432 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 68.2 m80 -97.62 139.1 34.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.334 -0.854 . . . . 0.0 109.707 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 64.4 tttt -94.58 119.34 33.1 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.078 -1.014 . . . . 0.0 110.566 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.682 HD11 ' HD3' ' A' ' 35' ' ' LYS . 9.5 mt -90.59 -38.98 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 108.921 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.404 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -163.46 -163.72 16.9 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.45 HG22 ' N ' ' A' ' 27' ' ' CYS . 29.2 m -104.5 168.24 9.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.084 -1.245 . . . . 0.0 110.259 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.516 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 59.7 m -119.18 -171.67 2.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.38 -0.825 . . . . 0.0 109.824 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 55.1 t30 -93.77 153.65 18.19 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.192 -0.942 . . . . 0.0 110.469 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 1.8 t80 72.2 36.64 1.06 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.34 -0.85 . . . . 0.0 110.499 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 99.7 mtt180 60.27 52.11 5.1 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.356 -0.84 . . . . 0.0 111.055 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.516 ' CB ' ' HB2' ' A' ' 27' ' ' CYS . 25.0 m-85 -125.74 140.99 52.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.199 -0.938 . . . . 0.0 109.831 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.505 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 34.2 mmtp -87.9 156.79 19.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.065 -1.022 . . . . 0.0 109.597 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 27.6 t -102.63 123.2 45.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.229 -0.919 . . . . 0.0 109.866 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 50.6 m -141.63 154.17 45.21 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.149 -0.97 . . . . 0.0 110.577 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.682 ' HD3' HD11 ' A' ' 24' ' ' ILE . 53.1 mtpt -134.89 159.35 41.69 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.968 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -112.04 126.1 54.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.09 -1.006 . . . . 0.0 110.377 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.313 179.907 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.237 0.541 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.7 m -57.96 -24.25 57.2 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.397 -0.814 . . . . 0.0 109.762 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -60.96 -36.76 80.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 109.781 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -67.64 -40.22 84.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.361 -0.837 . . . . 0.0 109.889 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -65.73 -25.71 67.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.292 -0.88 . . . . 0.0 110.048 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.89 1.58 57.28 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.801 -1.319 . . . . 0.0 109.801 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.98 -172.01 7.62 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -130.54 143.91 51.06 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.199 -1.177 . . . . 0.0 110.256 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.868 ' C ' HD22 ' A' ' 14' ' ' LEU . 30.1 m -105.21 122.88 46.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.388 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.868 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.8 mm? -122.98 144.8 49.01 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.37 -0.831 . . . . 0.0 110.1 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -57.54 -19.27 24.02 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.171 -0.955 . . . . 0.0 110.011 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' A' ' 17' ' ' CYS . 32.5 ttm180 -168.62 72.96 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.359 -0.838 . . . . 0.0 109.863 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 61.2 m -40.03 147.91 0.09 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.513 -0.742 . . . . 0.0 110.54 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.534 HG22 ' N ' ' A' ' 19' ' ' GLY . 63.0 mt -84.47 173.84 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.344 -0.847 . . . . 0.0 109.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.534 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -53.73 -46.36 67.32 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.779 ' C ' HD13 ' A' ' 20' ' ' LEU . 3.4 tm? -51.12 -44.79 61.41 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.483 ' CE2' ' CD1' ' A' ' 36' ' ' PHE . 94.6 m-85 -76.39 149.52 36.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.889 . . . . 0.0 110.829 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.451 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.9 m-70 -114.25 143.56 44.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.357 -0.839 . . . . 0.0 109.665 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 39.8 ttpt -99.36 121.6 41.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.131 -0.98 . . . . 0.0 110.75 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.445 HD11 ' HB2' ' A' ' 35' ' ' LYS . 6.0 mt -85.77 -33.51 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.321 -0.862 . . . . 0.0 108.941 179.151 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -167.5 -131.91 1.34 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 108.907 -1.677 . . . . 0.0 108.907 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.5 m -130.19 163.41 26.73 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.134 -1.215 . . . . 0.0 110.207 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.522 ' O ' ' N ' ' A' ' 29' ' ' PHE . 1.1 t -94.87 -156.61 0.52 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 0.0 110.488 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.447 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 78.8 m-20 -64.99 56.84 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.762 -0.586 . . . . 0.0 111.021 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 88.3 t80 53.0 17.11 0.83 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.183 -0.948 . . . . 0.0 110.911 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 28' ' ' ASN . 97.1 mtt180 -125.87 -40.79 2.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.886 -1.133 . . . . 0.0 110.366 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.502 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 99.1 m-85 -128.16 170.05 13.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.224 -0.923 . . . . 0.0 110.077 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 74.6 mmtt -87.62 157.16 19.19 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.893 . . . . 0.0 109.927 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.48 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.8 t -94.35 110.77 22.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.305 -0.872 . . . . 0.0 109.954 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 99.3 m -129.42 163.95 24.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.38 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HB2' HD11 ' A' ' 24' ' ' ILE . 61.6 tttp -131.53 132.31 44.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.352 -0.843 . . . . 0.0 110.016 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.483 ' CD1' ' CE2' ' A' ' 21' ' ' PHE . 61.1 t80 -107.26 123.64 48.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.142 -0.974 . . . . 0.0 110.264 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 117.945 -1.026 . . . . 0.0 110.25 -179.863 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.203 0.525 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.6 t -60.53 -26.24 66.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.348 -0.845 . . . . 0.0 110.076 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -65.46 -35.68 81.64 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.297 -0.877 . . . . 0.0 110.162 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.1 mmm180 -99.7 -56.06 2.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.957 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -80.97 -26.56 36.49 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.299 -0.876 . . . . 0.0 109.969 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.468 ' CA ' ' O ' ' A' ' 6' ' ' CYS . . . -89.41 9.07 78.37 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.45 ' HA3' ' O ' ' A' ' 34' ' ' CYS . . . 57.62 -117.2 9.42 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.476 ' HG3' ' CE1' ' A' ' 36' ' ' PHE . 95.5 mt-10 -120.07 145.28 47.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.257 -1.143 . . . . 0.0 110.317 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 85.4 m -93.99 125.44 38.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.272 -0.892 . . . . 0.0 109.673 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 14' ' ' LEU . 11.6 tp -128.47 164.86 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.489 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.577 ' CG ' ' CE1' ' A' ' 31' ' ' PHE . 90.9 mt-30 -73.75 -42.4 61.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.331 -0.855 . . . . 0.0 109.756 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.2 mtt-85 -122.37 63.14 0.95 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.36 -0.837 . . . . 0.0 109.48 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.469 ' C ' ' O ' ' A' ' 16' ' ' ARG . 45.3 t -34.54 118.45 0.4 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.395 0.617 . . . . 0.0 111.137 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.62 HD11 ' CD1' ' A' ' 21' ' ' PHE . 37.9 pt -59.25 168.64 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.325 -0.859 . . . . 0.0 109.999 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -77.2 -50.46 6.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.432 ' C ' ' O ' ' A' ' 19' ' ' GLY . 48.5 tp -40.91 -32.64 0.24 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.544 -0.974 . . . . 0.0 110.565 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.62 ' CD1' HD11 ' A' ' 18' ' ' ILE . 7.0 m-30 -91.99 115.48 28.11 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.442 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 62.6 t-80 -66.22 139.86 58.12 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.322 -0.861 . . . . 0.0 110.285 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 33' ' ' CYS . 39.5 ttpt -101.24 107.66 19.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.225 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.519 HG13 ' N ' ' A' ' 25' ' ' GLY . 32.3 pt -70.56 -27.48 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.27 -0.894 . . . . 0.0 109.965 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.519 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 177.7 -135.48 2.74 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -127.77 166.15 18.73 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.198 -1.178 . . . . 0.0 110.441 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 74.4 m -100.63 -176.96 3.34 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.655 -0.653 . . . . 0.0 109.684 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.491 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.3 t30 -80.67 52.04 1.61 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.009 -1.057 . . . . 0.0 109.52 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.491 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 79.5 t80 -179.91 176.91 0.71 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.691 -0.63 . . . . 0.0 109.893 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.433 ' N ' ' CG ' ' A' ' 29' ' ' PHE . 91.1 mmt-85 -53.59 -16.83 1.73 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.13 -0.981 . . . . 0.0 110.887 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 15' ' ' GLN . 7.1 m-30 -76.64 167.13 22.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.025 -1.047 . . . . 0.0 110.357 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 43.3 mmtm -120.32 161.37 21.26 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 110.195 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 83.1 m -86.35 133.66 33.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.138 -0.976 . . . . 0.0 110.409 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.45 ' O ' ' HA3' ' A' ' 11' ' ' GLY . 62.6 m -141.36 147.17 37.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.895 . . . . 0.0 110.305 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HD2' HG21 ' A' ' 24' ' ' ILE . 51.2 mtpt -107.93 127.86 54.12 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.348 -0.845 . . . . 0.0 110.287 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.612 ' HB2' ' CZ ' ' A' ' 21' ' ' PHE . 41.0 p90 -126.48 162.75 24.89 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.159 -0.963 . . . . 0.0 110.128 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.163 179.842 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.293 0.568 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 t -61.0 -24.98 66.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.184 -0.947 . . . . 0.0 109.716 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -70.15 -29.37 66.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.399 -0.813 . . . . 0.0 109.711 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -67.79 -33.45 74.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.3 -0.875 . . . . 0.0 110.166 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.634 ' HB3' HD13 ' A' ' 24' ' ' ILE . 52.7 mt-10 -59.94 -26.58 66.08 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.263 -0.898 . . . . 0.0 110.269 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.76 -12.52 68.54 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.27 179.87 53.34 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.524 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 79.6 mm-40 -122.36 147.03 46.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.225 -1.162 . . . . 0.0 110.085 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.648 ' C ' HD22 ' A' ' 14' ' ' LEU . 74.9 m -86.16 124.22 32.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.21 -0.931 . . . . 0.0 110.106 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.765 HD22 ' N ' ' A' ' 14' ' ' LEU . 3.1 mm? -110.94 139.34 46.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.553 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.539 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 29.3 pt20 -65.28 -26.55 68.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.324 -0.86 . . . . 0.0 109.894 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' CYS . 76.3 mtm-85 -140.86 55.82 1.57 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.414 -0.804 . . . . 0.0 109.66 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' ARG . 15.9 t -38.69 143.86 0.13 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.574 -0.704 . . . . 0.0 110.589 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.581 HD12 HD12 ' A' ' 20' ' ' LEU . 40.4 pt -120.86 175.74 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.321 -0.862 . . . . 0.0 110.137 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -55.48 -48.13 72.1 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.581 HD12 HD12 ' A' ' 18' ' ' ILE . 94.9 mt -44.14 -37.55 3.18 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.445 -1.032 . . . . 0.0 110.223 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -99.16 116.7 31.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.385 -0.822 . . . . 0.0 110.443 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -71.55 136.71 47.59 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.942 . . . . 0.0 109.568 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.522 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 86.3 tttt -86.56 100.9 12.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.069 -1.02 . . . . 0.0 110.487 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.634 HD13 ' HB3' ' A' ' 9' ' ' GLU . 13.8 tt -63.03 -41.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.347 -0.846 . . . . 0.0 109.835 179.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.569 ' N ' HG23 ' A' ' 24' ' ' ILE . . . -158.63 -132.49 1.4 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.48 HG22 ' CE ' ' A' ' 23' ' ' LYS . 38.9 p -138.77 138.61 37.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -1.156 . . . . 0.0 110.047 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.487 ' HB3' ' O ' ' A' ' 31' ' ' PHE . 1.4 t -98.1 -159.64 0.75 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.167 -0.958 . . . . 0.0 109.64 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.525 ' OD1' ' N ' ' A' ' 31' ' ' PHE . 22.1 p30 -51.94 164.17 0.29 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.512 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -59.35 -12.62 6.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.98 -1.075 . . . . 0.0 111.346 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.605 ' HG3' ' CE1' ' A' ' 31' ' ' PHE . 46.7 tpt85 -98.78 -10.28 23.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.869 -1.144 . . . . 0.0 110.693 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.605 ' CE1' ' HG3' ' A' ' 30' ' ' ARG . 87.7 m-85 -144.38 154.63 43.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.959 -1.088 . . . . 0.0 110.647 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 87.3 mttt -106.91 155.22 19.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.444 ' HB2' ' C ' ' A' ' 25' ' ' GLY . 27.1 m -89.09 122.94 32.9 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.111 -0.993 . . . . 0.0 110.852 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.715 ' HB2' HD23 ' A' ' 14' ' ' LEU . 96.7 m -141.59 161.94 36.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.34 -0.85 . . . . 0.0 110.157 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -140.94 157.09 45.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.242 -0.911 . . . . 0.0 110.231 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.7 t80 -108.71 135.56 49.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.217 -0.927 . . . . 0.0 110.091 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.44 ' HG3' ' OXT' ' A' ' 37' ' ' GLN . 8.2 tp60 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.069 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.296 0.57 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.0 t -57.49 -20.92 34.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.918 . . . . 0.0 110.139 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -69.92 -42.68 72.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.841 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -63.77 -34.24 77.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.374 -0.829 . . . . 0.0 109.944 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.415 ' OE1' ' SG ' ' A' ' 33' ' ' CYS . 97.7 mt-10 -64.37 -36.24 83.5 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.359 -0.838 . . . . 0.0 110.322 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.89 -4.58 28.96 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.21 -173.0 49.58 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -123.78 150.98 43.81 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.224 -1.162 . . . . 0.0 110.24 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.851 ' C ' HD22 ' A' ' 14' ' ' LEU . 25.7 m -92.78 116.17 28.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.207 -0.933 . . . . 0.0 110.311 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.851 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.2 mm? -121.37 132.89 55.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.209 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -53.54 -32.72 51.87 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.159 -0.963 . . . . 0.0 109.844 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 -150.89 64.72 0.92 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.348 -0.845 . . . . 0.0 110.25 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.512 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 19.3 p -55.16 168.77 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 110.402 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.541 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 41.4 pt -95.45 159.74 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.45 -0.781 . . . . 0.0 110.272 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.461 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -52.73 -45.87 60.13 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.541 ' HB2' ' CD1' ' A' ' 18' ' ' ILE . 9.9 mp -37.48 -36.02 0.15 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.858 -0.79 . . . . 0.0 110.451 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 8.7 m-30 -88.54 116.05 26.5 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.438 -0.789 . . . . 0.0 110.108 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.483 ' N ' ' O ' ' A' ' 35' ' ' LYS . 60.2 t-80 -68.64 141.95 55.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.046 -1.034 . . . . 0.0 109.95 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.2 ttmt -90.93 114.44 26.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.096 -1.002 . . . . 0.0 110.176 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.9 mt -78.15 -43.37 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.273 -0.892 . . . . 0.0 108.598 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.414 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -163.69 -141.7 3.2 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 43.0 p -131.18 154.83 47.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.249 -1.148 . . . . 0.0 110.361 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 64.8 m -83.88 -166.84 1.52 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.25 -0.906 . . . . 0.0 110.238 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.454 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 59.3 t30 -39.69 -49.51 2.26 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.529 -0.732 . . . . 0.0 110.736 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.454 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 89.6 t80 -178.83 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 111.025 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -66.48 -43.25 85.96 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.186 -0.946 . . . . 0.0 111.383 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.464 ' O ' ' HB2' ' A' ' 27' ' ' CYS . 93.3 m-85 -90.05 162.57 15.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.994 -1.067 . . . . 0.0 111.068 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 46.5 mttm -117.38 165.06 13.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.461 -0.774 . . . . 0.0 109.522 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 13.8 t -99.17 113.15 25.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.992 -1.068 . . . . 0.0 110.473 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.5 m -130.76 131.88 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.358 -0.839 . . . . 0.0 109.774 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 22' ' ' HIS . 80.9 tttt -134.98 155.66 50.38 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.233 -0.917 . . . . 0.0 110.573 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -95.14 137.11 34.63 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.332 -0.855 . . . . 0.0 110.068 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.291 179.931 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.149 0.5 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.1 t -60.99 -16.73 46.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -76.92 -40.08 48.47 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.221 -0.924 . . . . 0.0 109.717 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -60.25 -38.75 84.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.416 -0.803 . . . . 0.0 110.017 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.18 -37.12 84.84 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.273 -0.892 . . . . 0.0 110.079 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.08 21.1 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -86.16 -169.67 46.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -126.57 148.02 49.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.329 -1.101 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.663 ' C ' HD22 ' A' ' 14' ' ' LEU . 97.0 m -102.22 121.96 43.26 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.866 HD23 ' HB2' ' A' ' 34' ' ' CYS . 3.0 mm? -110.67 147.08 35.07 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.23 -0.918 . . . . 0.0 110.54 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.603 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 27.9 pt20 -75.07 -25.6 58.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -0.897 . . . . 0.0 109.936 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 17' ' ' CYS . 99.3 mtt180 -147.14 64.75 1.16 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.4 -0.812 . . . . 0.0 110.19 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 73.7 m -38.13 157.28 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.388 -0.82 . . . . 0.0 110.898 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 43.7 pt -127.38 172.67 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.393 -0.817 . . . . 0.0 109.943 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -46.84 -46.51 19.2 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.538 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 3.8 mm? -49.68 -36.23 24.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.518 -0.99 . . . . 0.0 110.703 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 53.2 m-85 -111.37 140.93 45.54 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.059 -179.122 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -112.93 134.25 54.53 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.33 -0.857 . . . . 0.0 109.353 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 34.9 ttpt -67.27 123.1 19.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.199 -0.938 . . . . 0.0 111.433 -178.726 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.2 mm -90.65 -35.38 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.438 ' C ' ' HB3' ' A' ' 33' ' ' CYS . . . -152.42 -133.17 1.9 Allowed Glycine 0 N--CA 1.486 1.997 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.412 HG22 ' N ' ' A' ' 27' ' ' CYS . 17.5 m -134.28 166.53 22.6 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.163 -1.198 . . . . 0.0 111.031 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 33' ' ' CYS . 91.2 m -143.29 -164.17 1.8 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.651 -0.656 . . . . 0.0 109.411 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.45 ' C ' ' O ' ' A' ' 27' ' ' CYS . 20.7 t-20 -40.53 155.45 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.804 . . . . 0.0 109.961 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -49.97 -35.48 24.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.16 -0.962 . . . . 0.0 111.017 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.41 ' NH1' ' OD1' ' A' ' 28' ' ' ASN . 91.8 mtm-85 -94.46 6.68 48.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.958 -1.089 . . . . 0.0 110.68 -179.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.603 ' CE1' ' HB3' ' A' ' 15' ' ' GLN . 95.9 m-85 -139.0 155.0 48.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.179 -0.951 . . . . 0.0 110.442 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.532 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 63.2 mttp -129.01 156.66 43.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.99 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.53 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 50.5 t -79.34 119.19 22.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.312 -0.868 . . . . 0.0 110.353 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.866 ' HB2' HD23 ' A' ' 14' ' ' LEU . 32.9 m -139.31 133.07 30.69 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 110.215 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -124.29 155.02 39.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.177 -0.952 . . . . 0.0 110.156 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -80.85 139.52 35.91 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.346 -0.846 . . . . 0.0 110.108 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 117.936 -1.031 . . . . 0.0 110.233 -179.943 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 1.025 ' HB1' ' CE1' ' A' ' 7' ' ' TYR . . . . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.277 0.56 . . . . 0.0 110.137 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -76.42 -16.6 59.66 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.199 -0.938 . . . . 0.0 110.067 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 1.025 ' CE1' ' HB1' ' A' ' 5' ' ' ALA . 50.9 p90 -80.23 -46.53 16.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 0.0 109.895 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.636 ' HG3' ' CE2' ' A' ' 7' ' ' TYR . 57.4 mtt180 -49.78 -36.52 26.37 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.59 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -60.68 -37.84 82.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.424 -0.797 . . . . 0.0 109.927 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.94 4.46 55.53 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -82.69 -158.82 25.28 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.511 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 85.4 tt0 -143.41 135.29 26.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -1.171 . . . . 0.0 110.211 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.987 ' C ' HD22 ' A' ' 14' ' ' LEU . 89.2 m -83.1 136.26 34.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.159 -0.963 . . . . 0.0 110.119 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.987 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.3 mm? -127.87 134.69 49.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.146 -0.971 . . . . 0.0 110.358 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.541 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 15.2 pt20 -59.98 -24.63 64.6 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.338 -0.851 . . . . 0.0 110.353 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.427 ' O ' ' C ' ' A' ' 17' ' ' CYS . 89.2 mmt-85 -142.65 50.58 1.46 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 109.981 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.427 ' C ' ' O ' ' A' ' 16' ' ' ARG . 12.6 t -42.15 138.85 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.367 -0.833 . . . . 0.0 110.387 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.9 pt -108.62 176.78 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 110.077 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -53.47 -49.1 58.46 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 19' ' ' GLY . 15.7 tp -41.36 -29.87 0.16 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.505 -0.997 . . . . 0.0 110.425 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.96 113.75 26.73 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.279 -0.888 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.499 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 93.0 m-70 -67.83 148.45 51.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.237 -0.914 . . . . 0.0 109.521 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 33' ' ' CYS . 37.0 ttpt -110.6 111.79 23.24 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.173 -0.954 . . . . 0.0 110.786 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 7.0 mt -71.28 -41.85 74.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.205 -0.934 . . . . 0.0 108.587 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.75 -156.26 8.15 Favored Glycine 0 N--CA 1.488 2.153 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 54.5 p -116.5 142.56 46.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.135 -1.215 . . . . 0.0 109.883 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.425 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 72.8 m -87.5 179.96 6.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.946 . . . . 0.0 109.999 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 63.9 t30 -62.48 151.27 37.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.162 -0.961 . . . . 0.0 110.449 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.517 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.4 t80 71.41 -140.46 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.294 -0.879 . . . . 0.0 110.642 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -98.22 3.89 48.9 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.171 -0.956 . . . . 0.0 110.64 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.541 ' CE2' ' HB3' ' A' ' 15' ' ' GLN . 75.9 m-85 -81.24 140.79 34.69 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.093 -1.005 . . . . 0.0 110.431 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HD2' ' N ' ' A' ' 32' ' ' LYS . 11.4 mptt -100.07 161.35 13.66 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.204 -0.935 . . . . 0.0 110.282 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 84.1 m -99.84 123.82 44.5 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.313 -0.867 . . . . 0.0 109.853 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 54.9 m -130.19 163.65 26.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.097 -1.002 . . . . 0.0 110.609 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -127.83 133.4 49.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.252 -0.905 . . . . 0.0 110.424 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -88.8 138.6 31.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.866 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.292 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.237 0.541 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.6 t -64.72 -22.88 67.08 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.221 -0.924 . . . . 0.0 109.771 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -62.98 -44.64 95.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.328 -0.857 . . . . 0.0 109.825 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.7 tpp180 -58.35 -41.08 83.9 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.343 -0.848 . . . . 0.0 109.995 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.62 ' OE1' HG21 ' A' ' 24' ' ' ILE . 93.5 mt-10 -63.79 -24.19 67.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.317 -0.864 . . . . 0.0 110.159 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.28 8.56 83.37 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.77 177.96 7.64 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.413 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 41.1 tt0 -116.71 127.41 54.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.182 -1.187 . . . . 0.0 110.07 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.601 ' C ' HD22 ' A' ' 14' ' ' LEU . 60.1 m -93.57 119.08 32.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.177 -0.952 . . . . 0.0 110.308 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.839 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.0 mm? -114.74 154.95 27.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.161 -0.962 . . . . 0.0 110.069 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.609 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 78.1 mt-30 -74.22 -17.24 60.91 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.25 -0.906 . . . . 0.0 110.021 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 15' ' ' GLN . 50.3 mtt180 -152.16 57.17 0.84 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.181 -0.949 . . . . 0.0 110.266 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 72.0 m -37.16 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.573 -0.704 . . . . 0.0 110.447 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.514 HG22 ' N ' ' A' ' 19' ' ' GLY . 72.3 mt -89.79 171.1 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.247 -0.908 . . . . 0.0 109.759 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.514 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -60.05 -45.49 95.85 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.41 ' HA ' HD12 ' A' ' 20' ' ' LEU . 29.0 tp -48.01 -43.64 30.11 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.611 -0.935 . . . . 0.0 110.951 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 66.8 m-85 -72.97 146.82 45.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.304 -0.873 . . . . 0.0 110.944 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.502 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 73.8 m80 -109.93 159.44 17.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.514 -0.741 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 60.6 tttm -94.99 108.32 20.38 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.03 -1.044 . . . . 0.0 110.7 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.62 HG21 ' OE1' ' A' ' 9' ' ' GLU . 20.7 mm -77.28 -42.19 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.885 . . . . 0.0 108.729 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.423 ' O ' ' NZ ' ' A' ' 23' ' ' LYS . . . -153.41 -129.28 1.36 Allowed Glycine 0 N--CA 1.486 2.027 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.5 p -141.39 155.37 45.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.11 -1.23 . . . . 0.0 110.482 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.451 ' O ' ' C ' ' A' ' 28' ' ' ASN . 97.4 m -123.16 -167.79 1.66 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.397 -0.814 . . . . 0.0 109.757 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.451 ' C ' ' O ' ' A' ' 27' ' ' CYS . 84.6 m-20 -39.57 147.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.607 -0.683 . . . . 0.0 110.169 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.408 ' C ' ' O ' ' A' ' 28' ' ' ASN . 78.7 t80 -42.39 -41.17 2.78 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -0.938 . . . . 0.0 110.792 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -85.24 4.35 35.15 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.114 -0.991 . . . . 0.0 110.853 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.609 ' CE2' ' CG ' ' A' ' 15' ' ' GLN . 96.0 m-85 -139.96 157.03 46.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.071 -1.018 . . . . 0.0 110.66 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.505 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 57.5 mttp -127.39 157.64 39.45 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.426 -0.797 . . . . 0.0 109.825 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 44.5 t -80.93 127.13 32.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.273 -0.892 . . . . 0.0 110.924 -179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.7 m -141.6 140.32 33.32 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.503 -0.748 . . . . 0.0 109.916 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -136.21 152.7 51.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.15 -0.969 . . . . 0.0 110.329 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.562 ' CE1' ' CZ ' ' A' ' 21' ' ' PHE . 67.5 m-85 -61.73 167.38 3.64 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.303 -0.873 . . . . 0.0 110.015 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.142 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.245 0.545 . . . . 0.0 110.462 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.6 m -61.57 -22.25 65.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.774 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -66.71 -44.02 82.76 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.388 -0.82 . . . . 0.0 109.975 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -59.75 -40.63 88.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.409 -0.807 . . . . 0.0 109.97 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -67.95 -27.62 66.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.338 -0.851 . . . . 0.0 110.152 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.04 11.07 59.15 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.18 -177.68 9.8 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -125.07 145.69 49.8 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.287 -1.125 . . . . 0.0 110.275 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.539 ' O ' HD23 ' A' ' 14' ' ' LEU . 84.8 m -124.46 131.0 53.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.361 -0.837 . . . . 0.0 110.141 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.539 HD23 ' O ' ' A' ' 13' ' ' CYS . 25.3 mt -120.02 146.08 46.21 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -55.66 -28.05 53.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.162 -0.961 . . . . 0.0 108.671 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.46 ' O ' HG13 ' A' ' 18' ' ' ILE . 99.1 mtt180 -135.71 63.58 1.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.45 ' C ' HG13 ' A' ' 18' ' ' ILE . 42.3 t -49.56 116.74 1.88 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.53 -0.731 . . . . 0.0 111.06 -179.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.593 HG22 ' N ' ' A' ' 19' ' ' GLY . 61.5 mt -151.26 172.68 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.414 -0.804 . . . . 0.0 109.499 179.22 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.593 ' N ' HG22 ' A' ' 18' ' ' ILE . . . 92.53 -162.02 26.53 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.4 mt -53.5 -19.96 4.31 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.388 -1.066 . . . . 0.0 110.474 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -75.57 145.45 41.21 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.282 -0.886 . . . . 0.0 110.365 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.435 ' CD2' HG12 ' A' ' 24' ' ' ILE . 35.2 p-80 -121.58 176.79 5.51 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.447 ' HE3' ' HD2' ' A' ' 32' ' ' LYS . 86.4 tttt -103.7 110.86 23.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.449 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 35' ' ' LYS . 7.1 mt -88.23 -34.85 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.85 . . . . 0.0 109.069 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.11 -163.25 21.73 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 m -94.15 165.69 12.49 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.026 -1.279 . . . . 0.0 110.614 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 31' ' ' PHE . 1.1 t -122.78 -158.55 0.79 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.379 -0.826 . . . . 0.0 110.183 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -71.95 151.75 43.04 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.649 -0.657 . . . . 0.0 110.565 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 8.9 t80 48.3 -124.88 1.83 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.473 -0.767 . . . . 0.0 110.778 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -104.92 14.52 29.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.882 -1.136 . . . . 0.0 111.197 -179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.429 ' O ' ' HB3' ' A' ' 27' ' ' CYS . 60.1 m-85 -84.07 142.55 30.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.012 -1.055 . . . . 0.0 110.189 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HD2' ' HE3' ' A' ' 23' ' ' LYS . 75.2 mmtt -90.07 159.16 16.96 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.28 -0.888 . . . . 0.0 110.65 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.46 ' HA ' ' SG ' ' A' ' 13' ' ' CYS . 16.8 t -89.6 131.81 35.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.309 -0.869 . . . . 0.0 109.985 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.406 ' SG ' ' O ' ' A' ' 22' ' ' HIS . 67.3 m -149.54 137.01 20.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.155 -0.966 . . . . 0.0 110.518 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.556 ' HB2' HD11 ' A' ' 24' ' ' ILE . 58.7 mtpt -125.96 157.8 36.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.451 -0.78 . . . . 0.0 110.024 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -95.51 132.43 40.62 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.245 -0.909 . . . . 0.0 110.29 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.216 179.932 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.276 0.56 . . . . 0.0 110.437 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 80.5 m -58.52 -23.09 57.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -68.75 -44.04 74.57 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.343 -0.848 . . . . 0.0 110.267 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -65.12 -41.84 94.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -0.928 . . . . 0.0 110.143 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.65 -29.48 68.07 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.158 -0.964 . . . . 0.0 110.093 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.85 3.74 68.0 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -74.47 -169.55 22.21 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 34' ' ' CYS . 87.9 mt-10 -133.2 149.08 52.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -1.091 . . . . 0.0 109.788 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.808 ' C ' HD22 ' A' ' 14' ' ' LEU . 72.9 m -109.9 129.95 55.59 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.05 -1.031 . . . . 0.0 110.446 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.815 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -118.98 145.65 45.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.355 -0.841 . . . . 0.0 110.191 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -63.13 -29.14 70.56 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.061 -1.024 . . . . 0.0 109.074 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.478 ' O ' ' C ' ' A' ' 17' ' ' CYS . 87.4 mtm180 -138.79 59.49 1.62 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.591 -0.693 . . . . 0.0 109.678 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.478 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.2 t -33.87 132.34 0.24 Allowed 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.5 0.667 . . . . 0.0 111.061 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.565 HG22 ' N ' ' A' ' 19' ' ' GLY . 75.5 mt -91.25 173.65 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.437 -0.789 . . . . 0.0 110.31 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.565 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -59.62 -50.89 62.85 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.695 ' C ' HD13 ' A' ' 20' ' ' LEU . 3.3 tm? -44.11 -45.53 8.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.4 -1.059 . . . . 0.0 110.045 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -80.04 135.7 36.41 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.421 -0.799 . . . . 0.0 109.995 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.438 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.5 m-70 -99.43 137.42 37.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.127 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.521 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 85.5 tttt -88.75 119.25 29.06 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.317 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.749 HD11 ' SG ' ' A' ' 33' ' ' CYS . 37.4 pt -86.16 -30.35 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.257 -0.902 . . . . 0.0 110.124 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.53 ' N ' HG13 ' A' ' 24' ' ' ILE . . . -168.23 -135.64 1.91 Allowed Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -121.22 140.43 52.04 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.239 -1.154 . . . . 0.0 110.523 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.472 ' HB2' ' C ' ' A' ' 32' ' ' LYS . 1.6 t -110.79 -161.6 0.76 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 27' ' ' CYS . 83.5 m-20 -46.23 141.99 3.12 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 119.693 -0.803 . . . . 0.0 109.447 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.98 -21.36 0.13 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.075 -1.015 . . . . 0.0 110.797 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.487 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 16.2 tpt180 -93.24 -3.64 53.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.003 -1.061 . . . . 0.0 110.424 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -148.11 157.01 43.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.854 -1.154 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.509 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 73.3 mmtt -101.88 158.34 16.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.365 -0.834 . . . . 0.0 109.69 179.58 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.749 ' SG ' HD11 ' A' ' 24' ' ' ILE . 7.0 t -85.85 115.07 23.27 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.143 -0.973 . . . . 0.0 110.421 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.491 ' O ' ' N ' ' A' ' 12' ' ' GLU . 85.0 m -131.96 142.57 49.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.356 -0.84 . . . . 0.0 110.07 179.796 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -123.72 129.1 50.57 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.989 . . . . 0.0 110.371 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -80.71 139.93 35.86 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.917 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.113 179.906 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.208 0.527 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.5 t -59.54 -23.08 62.56 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.222 -0.924 . . . . 0.0 109.943 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -70.37 -40.18 74.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.257 -0.902 . . . . 0.0 110.004 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -66.63 -33.45 75.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.306 -0.871 . . . . 0.0 109.875 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -65.34 -34.54 78.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 19.78 78.09 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.61 -152.3 7.16 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -121.06 146.85 46.28 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -1.192 . . . . 0.0 109.836 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.861 ' C ' HD22 ' A' ' 14' ' ' LEU . 74.2 m -121.73 116.4 24.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.967 . . . . 0.0 110.367 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.861 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.9 mm? -120.93 147.32 45.6 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.321 -0.862 . . . . 0.0 109.764 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.438 ' OE1' ' HA ' ' A' ' 31' ' ' PHE . 16.2 mm-40 -54.78 -21.42 11.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.98 -1.075 . . . . 0.0 109.347 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -169.34 71.76 0.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.583 -0.698 . . . . 0.0 109.701 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 28.7 p -63.99 145.29 56.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.0 110.741 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 32.5 pt -141.1 159.23 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.641 -0.662 . . . . 0.0 110.153 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.57 -145.81 17.33 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.498 ' O ' ' CD2' ' A' ' 22' ' ' HIS . 26.3 mt -61.85 -16.18 48.2 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.399 -1.06 . . . . 0.0 110.228 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -72.59 135.34 45.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.339 -0.85 . . . . 0.0 111.028 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.515 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 94.6 m-70 -121.53 151.76 39.95 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.412 -0.805 . . . . 0.0 109.016 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.509 ' HE2' HG22 ' A' ' 26' ' ' THR . 60.2 tttm -93.54 126.64 38.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.868 -1.145 . . . . 0.0 111.66 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mt -101.49 -37.17 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.46 -148.59 5.17 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 43.5 p -136.31 149.0 48.23 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.072 -1.252 . . . . 0.0 110.469 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 8.1 m -115.69 163.91 15.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.355 -0.841 . . . . 0.0 109.732 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.52 ' O ' ' N ' ' A' ' 30' ' ' ARG . 54.8 t-20 38.98 29.72 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.432 -0.792 . . . . 0.0 110.692 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.486 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 85.1 t80 60.34 -74.75 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.437 -0.789 . . . . 0.0 110.509 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 28' ' ' ASN . 81.6 mtt180 -58.39 -49.35 77.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.2 -0.938 . . . . 0.0 110.513 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.438 ' HA ' ' OE1' ' A' ' 15' ' ' GLN . 90.5 m-85 -71.05 158.47 36.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.19 -0.943 . . . . 0.0 110.516 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 71.3 mmtt -108.58 168.35 9.4 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.0 t -107.0 133.87 51.0 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.185 -0.947 . . . . 0.0 109.787 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 96.1 m -140.52 134.69 30.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.453 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -110.79 148.65 31.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.354 -0.841 . . . . 0.0 110.401 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -81.87 145.21 30.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.223 -0.923 . . . . 0.0 109.925 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.489 ' OE1' ' CD2' ' A' ' 22' ' ' HIS . 61.6 tt0 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.263 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.668 ' HB3' ' HD2' ' A' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.384 0.611 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.9 t -52.75 -27.2 16.78 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -69.69 -33.68 72.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.363 -0.836 . . . . 0.0 110.129 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.668 ' HD2' ' HB3' ' A' ' 5' ' ' ALA . 79.8 mtt85 -73.95 -29.74 62.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.2 -0.938 . . . . 0.0 109.924 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.29 -24.42 63.95 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.72 4.52 36.71 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.425 ' CA ' ' HG2' ' A' ' 35' ' ' LYS . . . -86.78 -173.9 49.05 Favored Glycine 0 N--CA 1.49 2.233 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -124.96 142.8 51.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.21 -1.171 . . . . 0.0 110.224 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.789 ' C ' HD22 ' A' ' 14' ' ' LEU . 48.0 m -92.99 133.14 36.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.272 -0.892 . . . . 0.0 110.185 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.789 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.9 mm? -130.8 142.45 50.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.222 -0.924 . . . . 0.0 110.142 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.455 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 89.0 mt-30 -74.27 -21.68 59.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.294 -0.879 . . . . 0.0 110.569 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.424 ' O ' ' C ' ' A' ' 17' ' ' CYS . 92.1 mtt180 -148.83 62.01 1.06 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.108 -0.995 . . . . 0.0 110.639 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.492 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 92.5 m -41.86 144.18 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.159 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.41 HG22 ' HD1' ' A' ' 21' ' ' PHE . 16.8 tt -119.5 176.73 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.168 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.08 -45.21 26.68 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.403 ' HB2' HG23 ' A' ' 18' ' ' ILE . 99.5 mt -52.68 -29.47 26.75 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.608 -0.936 . . . . 0.0 110.652 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.485 ' CE2' ' HB2' ' A' ' 36' ' ' PHE . 87.9 m-85 -113.38 146.06 40.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.126 -0.984 . . . . 0.0 110.542 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.448 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.1 m-70 -106.87 134.12 50.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.736 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 39.0 ttpt -92.92 97.65 10.87 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.117 -0.989 . . . . 0.0 110.617 -179.603 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.601 HG23 ' N ' ' A' ' 25' ' ' GLY . 18.9 tt -64.41 -43.39 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.161 -0.962 . . . . 0.0 109.832 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.601 ' N ' HG23 ' A' ' 24' ' ' ILE . . . -155.17 -148.11 4.91 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.4 p -120.99 150.11 41.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.251 -1.147 . . . . 0.0 110.133 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 32' ' ' LYS . 92.4 m -77.68 -169.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 110.423 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.439 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 81.0 m-20 -51.71 -39.75 58.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.215 -0.928 . . . . 0.0 110.481 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.552 ' CD2' ' HB2' ' A' ' 30' ' ' ARG . 60.0 t80 -179.32 150.59 0.44 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.49 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.552 ' HB2' ' CD2' ' A' ' 29' ' ' PHE . 68.2 ttt180 66.16 -59.15 0.33 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.437 -0.789 . . . . 0.0 111.127 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.475 ' N ' ' O ' ' A' ' 29' ' ' PHE . 96.6 m-85 -79.48 157.12 27.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 0.0 110.647 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.497 ' HD2' ' CD ' ' A' ' 23' ' ' LYS . 50.3 mtmt -110.14 158.33 18.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.484 -0.76 . . . . 0.0 109.989 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.529 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 37.7 t -86.89 118.21 26.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.185 -0.947 . . . . 0.0 110.464 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 55.6 m -138.71 132.4 30.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.367 -0.833 . . . . 0.0 110.024 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HG2' ' CA ' ' A' ' 11' ' ' GLY . 98.6 mttt -113.37 139.81 48.57 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.295 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HB2' ' CE2' ' A' ' 21' ' ' PHE . 91.2 t80 -108.13 142.89 37.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.324 -0.86 . . . . 0.0 110.149 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.192 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.275 0.559 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.536 ' CA ' ' HA3' ' A' ' 10' ' ' GLY . 59.5 m -71.9 -15.86 62.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -73.26 -29.64 62.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.293 -0.879 . . . . 0.0 110.444 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -83.89 -45.42 13.23 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.396 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -135.23 0.78 2.86 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.208 -0.932 . . . . 0.0 110.617 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.536 ' HA3' ' CA ' ' A' ' 6' ' ' CYS . . . -56.9 -23.2 44.63 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 72.15 -99.25 0.86 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -136.78 159.11 42.83 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -1.177 . . . . 0.0 110.303 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.49 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 57.7 m -120.24 150.04 41.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.21 -0.931 . . . . 0.0 110.655 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.719 HD12 ' H ' ' A' ' 15' ' ' GLN . 4.7 tp -148.45 160.28 43.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.351 -0.843 . . . . 0.0 109.872 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.719 ' H ' HD12 ' A' ' 14' ' ' LEU . 46.6 tt0 -69.22 -52.16 30.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.544 -0.723 . . . . 0.0 110.064 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -106.61 80.64 1.49 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.329 -0.857 . . . . 0.0 110.022 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.616 ' O ' HD13 ' A' ' 18' ' ' ILE . 7.2 t -77.11 81.07 3.63 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.616 HD13 ' O ' ' A' ' 17' ' ' CYS . 18.7 mm -136.85 166.84 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 110.487 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.414 ' N ' HG22 ' A' ' 18' ' ' ILE . . . 86.66 -128.06 8.7 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.406 ' HA ' HD12 ' A' ' 20' ' ' LEU . 23.7 tp -67.97 -32.17 72.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -1.141 . . . . 0.0 110.813 -179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 36' ' ' PHE . 90.7 m-85 -80.44 132.65 35.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.204 -0.935 . . . . 0.0 110.415 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -107.11 141.67 37.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.299 -0.875 . . . . 0.0 109.889 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.468 ' CD ' ' HD3' ' A' ' 32' ' ' LYS . 21.0 ttpt -89.42 114.01 25.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.142 -0.974 . . . . 0.0 110.473 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.411 HG13 ' HG3' ' A' ' 35' ' ' LYS . 22.7 mm -77.74 -41.89 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.309 -0.869 . . . . 0.0 108.761 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -164.12 -129.28 1.02 Allowed Glycine 0 N--CA 1.486 2.023 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 38.8 p -127.13 150.4 49.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.167 -1.196 . . . . 0.0 109.855 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.476 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -84.67 -160.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -0.997 . . . . 0.0 111.021 -179.62 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -62.48 -42.98 99.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.86 -0.525 . . . . 0.0 110.963 -179.325 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.565 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 81.7 t80 -177.08 143.98 0.42 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.17 -0.956 . . . . 0.0 110.543 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.538 ' O ' ' CD1' ' A' ' 31' ' ' PHE . 12.0 tpp180 52.33 19.63 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.284 -0.885 . . . . 0.0 110.255 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.565 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 47.9 m-85 -149.62 154.63 38.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 0.0 110.044 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.468 ' HD3' ' CD ' ' A' ' 23' ' ' LYS . 62.8 mttp -112.5 158.1 20.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.233 -0.917 . . . . 0.0 110.455 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.0 t -85.21 124.5 31.93 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.315 -0.866 . . . . 0.0 109.838 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 65.3 m -135.54 141.59 45.25 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.181 -0.95 . . . . 0.0 110.531 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.411 ' HG3' HG13 ' A' ' 24' ' ' ILE . 58.2 mtpt -116.59 127.31 54.37 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.31 -0.869 . . . . 0.0 109.909 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.401 ' CD1' ' CE1' ' A' ' 21' ' ' PHE . 92.2 t80 -98.41 139.72 33.74 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.173 -0.954 . . . . 0.0 110.562 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.085 179.747 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.873 ' HB1' ' CE2' ' A' ' 7' ' ' TYR . . . . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.342 0.591 . . . . 0.0 109.767 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -74.73 -21.2 59.49 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.432 -0.792 . . . . 0.0 110.02 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.873 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 53.2 p90 -69.31 -44.73 71.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.413 -0.804 . . . . 0.0 109.647 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.63 ' N ' ' CD1' ' A' ' 7' ' ' TYR . 38.9 ttm180 -57.68 -42.66 84.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.37 -0.831 . . . . 0.0 109.906 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.442 ' OE1' HD13 ' A' ' 24' ' ' ILE . 41.6 mt-10 -67.02 -29.68 69.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.068 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.16 9.56 61.94 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.15 176.68 26.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -132.21 146.47 52.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.246 -1.15 . . . . 0.0 110.326 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.495 ' O ' HD23 ' A' ' 14' ' ' LEU . 79.1 m -103.57 130.76 51.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.255 -0.903 . . . . 0.0 109.95 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 13' ' ' CYS . 15.0 mt -112.32 141.58 45.87 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.148 -0.97 . . . . 0.0 110.499 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -56.64 -24.74 50.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 0.0 109.665 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.415 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.9 mtt-85 -137.91 55.12 1.78 Allowed 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.6 t -39.81 130.71 1.94 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.528 -0.733 . . . . 0.0 110.725 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.484 HG22 ' N ' ' A' ' 19' ' ' GLY . 40.7 mm -100.23 171.03 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.473 -0.767 . . . . 0.0 110.203 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.484 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -59.09 -46.41 93.8 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.403 ' C ' ' O ' ' A' ' 19' ' ' GLY . 34.0 tp -42.1 -37.92 1.54 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.607 -0.937 . . . . 0.0 110.179 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.457 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 88.4 m-85 -89.22 113.55 24.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.357 -0.839 . . . . 0.0 110.433 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.483 ' O ' ' N ' ' A' ' 35' ' ' LYS . 85.3 t60 -62.53 138.84 58.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.284 -0.885 . . . . 0.0 109.834 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -99.54 112.13 24.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 110.451 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.442 HD13 ' OE1' ' A' ' 9' ' ' GLU . 15.1 mt -72.63 -39.61 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.289 -0.882 . . . . 0.0 108.658 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.412 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -174.56 -129.7 1.21 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.8 p -120.22 155.8 32.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.209 -1.171 . . . . 0.0 110.028 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' PHE . 0.6 OUTLIER -94.59 -159.38 0.7 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -0.999 . . . . 0.0 110.438 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 43.9 t30 -43.09 -53.12 5.08 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.699 -0.625 . . . . 0.0 110.222 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.448 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 58.7 t80 -178.66 -61.84 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.49 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -68.8 -34.63 75.85 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.27 -0.894 . . . . 0.0 110.98 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.495 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 91.2 m-85 -103.51 156.11 18.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.018 -1.051 . . . . 0.0 110.591 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -102.7 159.25 15.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.389 -0.819 . . . . 0.0 109.936 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.412 ' HB3' ' H ' ' A' ' 25' ' ' GLY . 34.2 t -82.88 127.97 33.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.24 -0.913 . . . . 0.0 110.122 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 57.5 m -134.01 152.86 52.02 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.148 -0.97 . . . . 0.0 110.404 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.483 ' N ' ' O ' ' A' ' 22' ' ' HIS . 52.9 tttp -127.62 119.77 26.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.357 -0.839 . . . . 0.0 110.156 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -77.22 141.38 40.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.245 -0.91 . . . . 0.0 110.264 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.441 ' CG ' ' OXT' ' A' ' 37' ' ' GLN . 3.6 tt0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 117.934 -1.032 . . . . 0.0 110.167 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.205 0.526 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.6 p -62.71 -38.21 89.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.257 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -123.76 153.78 40.45 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 0.0 110.177 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -126.29 162.48 25.38 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.234 -0.916 . . . . 0.0 110.231 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.35 111.96 13.58 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -0.891 . . . . 0.0 110.193 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.95 -24.42 67.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.93 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -66.55 -43.86 83.94 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.888 . . . . 0.0 110.018 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -63.31 -35.22 79.65 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.295 -0.878 . . . . 0.0 109.981 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -66.19 -31.02 71.6 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 110.148 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.61 32.75 29.65 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.14 -172.01 48.5 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -117.76 147.69 42.75 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.268 -1.136 . . . . 0.0 110.294 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.714 ' C ' HD22 ' A' ' 14' ' ' LEU . 16.1 m -99.08 120.24 39.15 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.747 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -116.11 138.19 51.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.126 -0.984 . . . . 0.0 110.402 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.53 ' HG2' ' CE1' ' A' ' 31' ' ' PHE . 74.1 mt-30 -65.52 -27.51 68.52 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.347 -0.846 . . . . 0.0 109.915 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.7 mtm180 -141.33 58.49 1.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.413 -0.805 . . . . 0.0 110.101 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.442 ' C ' ' O ' ' A' ' 16' ' ' ARG . 19.1 t -38.58 124.57 1.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.482 -0.761 . . . . 0.0 110.823 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.581 HG22 ' N ' ' A' ' 19' ' ' GLY . 72.0 mt -91.59 173.93 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.051 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.581 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -56.88 -48.7 76.59 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.753 HD13 ' O ' ' A' ' 20' ' ' LEU . 3.1 tm? -40.81 -40.8 1.43 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.541 -0.976 . . . . 0.0 110.439 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 93.4 m-85 -88.39 118.71 28.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.43 -0.794 . . . . 0.0 110.497 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.487 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 97.2 m-70 -67.59 150.07 49.26 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.132 -0.98 . . . . 0.0 109.507 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -105.28 125.55 51.11 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.041 -1.037 . . . . 0.0 111.026 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.0 mm -100.76 -37.53 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 CA-C-O 121.737 0.78 . . . . 0.0 109.021 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -171.83 -150.42 7.17 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.325 -1.51 . . . . 0.0 109.325 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.2 p -119.15 160.2 22.55 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -1.219 . . . . 0.0 110.345 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 86.4 m -87.1 -164.92 1.16 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.219 -0.925 . . . . 0.0 110.627 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -64.92 -42.18 94.91 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.552 -0.718 . . . . 0.0 110.861 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.64 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 66.8 t80 -175.09 140.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -0.924 . . . . 0.0 110.473 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.64 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 38.4 mmt180 57.47 20.68 6.26 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.392 -0.818 . . . . 0.0 110.449 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.53 ' CE1' ' HG2' ' A' ' 15' ' ' GLN . 43.7 m-85 -148.12 152.43 37.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.187 -0.946 . . . . 0.0 110.113 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 27' ' ' CYS . 92.9 mttt -117.81 158.07 25.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.174 -0.954 . . . . 0.0 109.921 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.3 t -94.81 119.34 33.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 87.0 m -136.37 165.12 26.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.387 -0.821 . . . . 0.0 110.063 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -127.83 141.66 51.51 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -106.59 139.14 41.51 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.312 -0.867 . . . . 0.0 110.058 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.273 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASN . . . . . 0.4 ' O ' ' HG3' ' A' ' 3' ' ' LYS . 27.1 m120 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.331 0.586 . . . . 0.0 110.141 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.1 m 52.21 47.38 24.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.175 -0.953 . . . . 0.0 110.26 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 1' ' ' ASN . 86.3 mttt -118.81 138.84 52.42 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.264 -0.898 . . . . 0.0 109.982 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 45.0 mtm-85 -128.07 167.77 16.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.182 -0.949 . . . . 0.0 110.256 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.55 ' HB3' ' HE ' ' A' ' 8' ' ' ARG . . . -92.3 108.44 19.96 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.325 -0.859 . . . . 0.0 110.45 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.5 t -59.39 -25.78 64.57 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.182 -0.948 . . . . 0.0 109.899 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -63.58 -41.89 98.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.295 -0.878 . . . . 0.0 110.114 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.55 ' HE ' ' HB3' ' A' ' 5' ' ' ALA . 53.6 mtm180 -75.17 -33.27 61.45 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.318 -0.864 . . . . 0.0 110.261 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -65.77 -25.78 67.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.317 -0.864 . . . . 0.0 110.116 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.96 12.83 73.3 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.2 165.21 13.01 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.423 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 68.4 mm-40 -100.92 141.61 33.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.302 -1.117 . . . . 0.0 110.255 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.7 m -100.19 129.87 46.26 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.168 -0.957 . . . . 0.0 110.436 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 14' ' ' LEU . 13.2 tp -124.44 166.67 15.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.085 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -79.23 -30.91 43.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.177 -0.952 . . . . 0.0 109.777 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 17' ' ' CYS . 34.0 ttm180 -146.66 76.33 1.43 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.0 109.312 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.437 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.8 t -36.08 126.07 0.75 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.431 0.634 . . . . 0.0 111.057 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.1 pt -95.95 178.82 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.338 -0.851 . . . . 0.0 110.253 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' A' ' 20' ' ' LEU . . . -56.9 -175.57 0.29 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 19' ' ' GLY . 60.0 mt 61.13 11.42 3.46 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -1.087 . . . . 0.0 110.332 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -135.78 131.0 34.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.0 110.505 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -99.34 142.09 31.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.421 -0.8 . . . . 0.0 109.481 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 84.7 tttt -95.72 112.04 23.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.055 -1.028 . . . . 0.0 111.166 -179.145 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.407 HD13 HG21 ' A' ' 24' ' ' ILE . 5.6 mt -87.99 -34.23 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.305 -0.872 . . . . 0.0 108.737 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.76 -156.68 8.33 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.5 p -123.61 156.33 36.0 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.198 -1.178 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.473 ' HB2' ' HB2' ' A' ' 31' ' ' PHE . 83.6 m -74.94 -166.7 0.5 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.375 -0.828 . . . . 0.0 110.427 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 47.4 t30 -71.64 -35.7 70.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.605 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.574 ' CE2' ' HG3' ' A' ' 30' ' ' ARG . 54.2 t80 179.64 144.96 0.18 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 110.141 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HG3' ' CE2' ' A' ' 29' ' ' PHE . 95.3 mtt180 57.18 19.01 4.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.408 -0.807 . . . . 0.0 110.972 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.473 ' HB2' ' HB2' ' A' ' 27' ' ' CYS . 44.1 m-85 -150.48 158.93 44.71 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.899 -1.125 . . . . 0.0 110.655 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.421 ' C ' ' SG ' ' A' ' 27' ' ' CYS . 35.6 mmtp -126.45 159.11 34.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.324 -0.86 . . . . 0.0 109.938 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 36.4 t -88.22 125.98 34.91 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.194 -0.941 . . . . 0.0 110.166 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 70.1 m -120.28 137.11 54.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 109.928 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -121.41 131.51 54.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.117 -0.99 . . . . 0.0 110.374 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 37' ' ' GLN . 62.2 t80 -103.45 128.17 50.67 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.473 ' HB3' ' O ' ' A' ' 36' ' ' PHE . 52.5 tt0 . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 72.9 m-80 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.193 0.52 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.2 p -60.43 -23.49 64.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.265 -0.897 . . . . 0.0 110.18 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -132.23 146.5 52.05 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.266 -0.896 . . . . 0.0 110.293 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -126.57 157.18 39.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.234 -0.916 . . . . 0.0 110.372 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.25 115.2 21.85 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.296 -0.878 . . . . 0.0 110.237 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.1 t -63.19 -21.02 65.94 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.231 -0.918 . . . . 0.0 110.062 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -70.48 -37.38 74.24 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.924 . . . . 0.0 109.747 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttp85 -63.75 -37.18 86.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.482 -0.761 . . . . 0.0 109.946 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.508 ' CD ' HD12 ' A' ' 24' ' ' ILE . 52.1 mt-10 -69.06 -33.6 73.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.082 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.25 14.87 79.72 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.92 161.83 49.1 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.361 -1.496 . . . . 0.0 109.361 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.525 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 76.3 tt0 -101.97 139.95 36.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -1.202 . . . . 0.0 110.392 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.88 ' C ' HD22 ' A' ' 14' ' ' LEU . 67.6 m -84.71 130.87 34.64 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.36 -0.838 . . . . 0.0 110.13 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.88 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.0 mm? -124.54 135.32 53.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 110.3 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.0 tp60 -62.99 -30.65 71.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.239 -0.913 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 17' ' ' CYS . 70.2 mtm180 -139.92 58.97 1.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.372 -0.83 . . . . 0.0 109.761 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.439 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.1 t -40.03 137.91 0.9 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.448 -0.783 . . . . 0.0 110.616 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 46.6 pt -114.14 179.53 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.363 -0.836 . . . . 0.0 110.499 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -54.5 -48.9 62.93 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 20' ' ' LEU . 15.5 tp -40.69 -41.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.649 -0.912 . . . . 0.0 110.45 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.488 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 90.1 m-85 -98.31 137.07 37.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.437 -0.789 . . . . 0.0 110.155 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -97.88 126.05 43.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.191 -0.943 . . . . 0.0 109.974 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.95 127.3 32.11 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.229 -0.919 . . . . 0.0 110.756 -179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.6 HG21 ' HB2' ' A' ' 35' ' ' LYS . 46.3 pt -103.44 -13.28 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.345 -0.847 . . . . 0.0 109.745 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.84 -136.78 3.74 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 3.1 m -138.16 157.61 45.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.097 -1.237 . . . . 0.0 110.227 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.448 ' O ' ' C ' ' A' ' 28' ' ' ASN . 72.8 m -93.7 -161.08 0.81 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.408 -0.808 . . . . 0.0 109.857 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.493 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.9 t30 -41.11 -46.56 3.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.521 -0.737 . . . . 0.0 110.149 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.493 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 92.3 t80 178.95 -63.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.397 -0.814 . . . . 0.0 110.816 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -61.99 -40.81 96.91 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.339 -0.85 . . . . 0.0 111.38 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.446 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 97.4 m-85 -96.01 164.27 12.78 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.067 -1.021 . . . . 0.0 111.492 -178.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.455 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 59.3 mttp -116.4 160.53 20.42 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.657 -0.652 . . . . 0.0 109.318 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 26' ' ' THR . 67.4 m -92.35 121.45 33.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.946 -1.096 . . . . 0.0 110.673 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.54 ' HB2' HD23 ' A' ' 14' ' ' LEU . 68.8 m -127.85 136.81 51.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.442 -0.786 . . . . 0.0 109.865 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.6 ' HB2' HG21 ' A' ' 24' ' ' ILE . 81.6 tttt -115.49 133.74 55.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.427 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -99.97 141.97 32.08 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.153 179.818 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 55.5 t30 . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.318 0.58 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -74.46 -35.72 63.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.208 -0.933 . . . . 0.0 110.207 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -57.62 -41.55 81.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.294 -0.879 . . . . 0.0 110.329 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -115.2 152.98 31.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.454 -0.779 . . . . 0.0 110.273 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -99.87 111.5 23.81 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.344 -0.848 . . . . 0.0 110.556 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.2 t -60.02 -23.26 63.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.959 . . . . 0.0 109.841 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -65.18 -37.7 88.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -62.53 -37.65 86.92 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.3 -0.875 . . . . 0.0 109.917 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.48 17.96 72.24 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -177.6 43.25 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -105.86 135.05 48.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.28 -1.13 . . . . 0.0 110.102 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.903 ' C ' HD22 ' A' ' 14' ' ' LEU . 87.9 m -92.91 130.52 38.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 110.239 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.903 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.2 mm? -132.09 143.64 50.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.386 -0.821 . . . . 0.0 110.119 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.539 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 11.2 pt20 -63.2 -33.22 75.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.213 -0.929 . . . . 0.0 109.428 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' A' ' 15' ' ' GLN . 78.8 mtt85 -158.4 61.97 0.44 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.601 -0.687 . . . . 0.0 109.714 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.598 ' O ' HG23 ' A' ' 18' ' ' ILE . 22.2 p -60.52 146.88 43.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.19 -0.944 . . . . 0.0 110.494 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.598 HG23 ' O ' ' A' ' 17' ' ' CYS . 29.5 pt -158.82 158.25 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.433 -0.792 . . . . 0.0 110.454 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.57 -119.75 4.98 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.6 mt -61.94 -23.16 66.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.31 -1.112 . . . . 0.0 110.554 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.438 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 80.0 m-85 -103.73 129.16 51.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.133 -0.98 . . . . 0.0 111.042 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -119.27 139.44 51.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.387 -0.82 . . . . 0.0 109.174 179.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -74.27 123.04 23.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.028 -1.045 . . . . 0.0 111.132 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.516 HG13 ' CG ' ' A' ' 35' ' ' LYS . 14.6 mm -93.38 -37.47 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -156.42 -143.49 3.68 Favored Glycine 0 N--CA 1.487 2.059 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 27.6 p -127.78 164.49 22.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.127 -1.219 . . . . 0.0 110.466 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.7 m -123.31 -176.96 3.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.243 -0.91 . . . . 0.0 110.125 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.512 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 51.6 t-20 -60.03 146.17 43.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 110.157 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.5 t80 70.98 -150.97 0.09 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.305 -0.872 . . . . 0.0 110.417 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -87.71 -5.4 58.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.255 -0.903 . . . . 0.0 110.732 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -72.09 138.9 48.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.183 -0.948 . . . . 0.0 110.234 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 94.2 mttt -103.18 164.93 11.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 13' ' ' CYS . 23.8 m -93.97 134.83 35.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 110.369 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.459 ' HB2' HD23 ' A' ' 14' ' ' LEU . 78.2 m -138.97 134.68 33.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.255 -0.903 . . . . 0.0 109.98 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.516 ' CG ' HG13 ' A' ' 24' ' ' ILE . 98.7 mttt -113.94 143.32 44.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.136 -0.978 . . . . 0.0 110.294 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 138.45 51.68 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 110.15 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.251 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.176 0.512 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.4 t -59.39 -43.57 92.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 110.053 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -99.09 139.85 34.13 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.186 -0.946 . . . . 0.0 110.264 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.409 ' NH1' HG22 ' A' ' 24' ' ' ILE . 54.2 ttp180 -79.28 153.28 30.0 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.248 -0.907 . . . . 0.0 109.795 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.05 98.82 5.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.241 -0.912 . . . . 0.0 110.451 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.9 m -54.55 -34.76 62.38 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.389 -0.82 . . . . 0.0 109.646 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -61.08 -42.63 98.86 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.519 -0.738 . . . . 0.0 109.847 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttt-85 -63.69 -35.49 80.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.44 -0.788 . . . . 0.0 110.235 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -71.39 -21.21 62.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 110.252 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.24 19.34 33.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -165.37 40.33 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 39.5 tp10 -135.88 148.49 48.64 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.242 -1.151 . . . . 0.0 110.178 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.774 ' C ' HD22 ' A' ' 14' ' ' LEU . 67.1 m -111.27 121.04 44.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.229 -0.919 . . . . 0.0 110.374 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.784 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -119.8 150.57 40.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.232 -0.918 . . . . 0.0 110.091 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -62.38 -35.2 78.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 0.0 109.699 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.772 ' O ' HG23 ' A' ' 18' ' ' ILE . 57.6 mtp180 -141.96 58.76 1.48 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.422 -0.799 . . . . 0.0 109.723 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 2.0 t -50.73 121.59 6.09 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.333 -0.855 . . . . 0.0 110.57 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.772 HG23 ' O ' ' A' ' 16' ' ' ARG . 25.9 pt -140.9 164.92 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.46 -0.775 . . . . 0.0 110.036 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.05 -151.71 17.61 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.5 mt -59.48 -17.99 36.16 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -1.167 . . . . 0.0 110.02 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -68.91 140.49 55.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.402 -0.811 . . . . 0.0 110.91 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 89.2 m-70 -114.63 162.51 16.68 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.316 -0.865 . . . . 0.0 109.413 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -91.48 111.96 23.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.929 -1.107 . . . . 0.0 110.848 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.409 HG22 ' NH1' ' A' ' 4' ' ' ARG . 10.4 mm -87.86 -35.19 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.06 -148.79 5.83 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 25.0 p -129.53 152.19 49.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.311 -1.111 . . . . 0.0 110.007 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.566 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 80.1 m -106.14 -174.75 2.61 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.109 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.522 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 93.3 m-20 -99.37 160.88 13.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.292 -0.88 . . . . 0.0 110.428 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.601 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 1.5 t80 71.16 39.03 1.0 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.28 -0.887 . . . . 0.0 110.271 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 95.5 mtt180 62.52 62.36 1.13 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 110.415 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.601 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 42.3 m-85 -145.68 155.06 42.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.218 -0.926 . . . . 0.0 110.055 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 48.2 mtmt -113.95 166.95 11.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.15 -0.969 . . . . 0.0 110.338 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.8 t -108.94 128.23 54.75 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 19.5 p -153.08 145.32 23.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.277 -0.889 . . . . 0.0 110.019 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -124.32 156.34 37.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.483 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -79.84 139.88 37.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.356 -0.84 . . . . 0.0 110.02 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.221 -179.802 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 65.5 m-80 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.179 0.514 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.6 t -101.14 139.26 37.07 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.166 -0.959 . . . . 0.0 110.136 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.405 ' HA ' ' OE2' ' A' ' 9' ' ' GLU . 60.9 mttm -61.96 -40.5 95.8 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.275 -0.89 . . . . 0.0 110.23 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.472 ' O ' ' O ' ' A' ' 5' ' ' ALA . 48.6 ttt180 -62.61 160.12 14.63 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.308 -0.87 . . . . 0.0 110.117 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.472 ' O ' ' O ' ' A' ' 4' ' ' ARG . . . 48.27 100.2 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.279 -0.888 . . . . 0.0 110.264 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.2 t -70.76 -28.57 64.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -59.7 -39.53 84.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.469 ' HD2' ' HB3' ' A' ' 5' ' ' ALA . 85.6 mtt180 -60.55 -42.27 96.21 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.314 -0.866 . . . . 0.0 110.116 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.405 ' OE2' ' HA ' ' A' ' 3' ' ' LYS . 97.6 mt-10 -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.295 -0.878 . . . . 0.0 110.019 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.38 -3.3 85.36 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.37 174.4 7.86 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 94.4 mt-10 -113.15 137.07 52.0 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.246 -1.15 . . . . 0.0 110.353 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.929 ' C ' HD22 ' A' ' 14' ' ' LEU . 15.7 m -85.39 124.09 31.59 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.28 -0.888 . . . . 0.0 109.99 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.929 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.3 mm? -124.57 146.15 49.2 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.13 -0.981 . . . . 0.0 110.161 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -63.74 -37.06 85.95 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.26 -0.9 . . . . 0.0 109.99 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 18' ' ' ILE . 37.2 ptt180 -137.01 58.12 1.73 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.23 -0.919 . . . . 0.0 109.607 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.577 ' C ' HG23 ' A' ' 18' ' ' ILE . 53.8 t -51.73 122.85 8.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.474 -0.766 . . . . 0.0 110.837 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.577 HG23 ' C ' ' A' ' 17' ' ' CYS . 19.4 pt -158.32 163.71 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.306 -0.871 . . . . 0.0 110.104 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.02 -145.62 16.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.73 -29.99 71.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.299 -1.118 . . . . 0.0 110.633 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 36' ' ' PHE . 95.5 m-85 -60.83 135.2 57.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.925 . . . . 0.0 110.422 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.46 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 98.0 m-70 -104.76 128.98 53.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.284 -0.885 . . . . 0.0 109.596 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.6 ttpt -81.32 115.76 20.84 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.144 -0.972 . . . . 0.0 110.828 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.668 HD11 ' HB2' ' A' ' 35' ' ' LYS . 11.1 mt -77.24 -47.4 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 108.868 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.41 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -158.79 -168.38 20.82 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.432 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 0.9 OUTLIER -94.08 158.33 15.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.071 -1.252 . . . . 0.0 110.154 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.547 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 57.4 m -85.07 -163.7 0.88 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.207 -0.933 . . . . 0.0 110.668 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 68.7 m-20 -63.18 -33.01 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 111.197 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.643 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 72.7 t80 -179.62 140.19 0.14 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.022 -1.049 . . . . 0.0 110.878 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.643 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 27.2 mmt85 49.03 25.4 1.09 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.277 -0.889 . . . . 0.0 110.658 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.547 ' CB ' ' HB2' ' A' ' 27' ' ' CYS . 33.6 m-85 -147.45 152.17 37.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.172 -0.955 . . . . 0.0 110.258 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.465 ' HE3' ' HB3' ' A' ' 17' ' ' CYS . 52.4 mtmt -115.41 155.31 27.65 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.931 . . . . 0.0 110.181 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 18.0 t -98.91 125.23 44.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.427 -0.795 . . . . 0.0 110.327 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.2 m -132.63 163.88 27.93 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.279 -0.888 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.668 ' HB2' HD11 ' A' ' 24' ' ' ILE . 87.8 tttt -131.93 140.56 49.06 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.365 -0.834 . . . . 0.0 109.97 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.563 ' HB3' ' CE1' ' A' ' 21' ' ' PHE . 44.6 p90 -123.64 161.43 25.06 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 110.256 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.409 -179.911 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 57.5 t30 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.182 0.515 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -79.0 144.48 34.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.326 -0.859 . . . . 0.0 110.126 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -74.97 143.92 43.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.144 -0.972 . . . . 0.0 110.366 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -122.64 151.97 40.95 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.227 -0.921 . . . . 0.0 110.028 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.3 101.55 12.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.202 -0.936 . . . . 0.0 109.92 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.81 -25.57 68.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.391 -0.818 . . . . 0.0 110.194 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -64.24 -38.93 92.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.357 -0.84 . . . . 0.0 110.078 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -57.82 -34.71 69.95 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.2 -0.937 . . . . 0.0 110.037 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -58.75 -29.23 66.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.235 -0.916 . . . . 0.0 110.109 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.85 10.76 34.2 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.54 -176.81 16.16 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.2 tp10 -110.01 130.28 55.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.258 -1.143 . . . . 0.0 109.952 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.914 ' C ' HD22 ' A' ' 14' ' ' LEU . 96.7 m -106.32 134.0 50.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.304 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.914 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.4 mm? -120.75 151.4 39.61 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.361 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -67.85 -24.91 65.31 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.373 -0.829 . . . . 0.0 109.619 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.451 ' O ' ' C ' ' A' ' 17' ' ' CYS . 81.3 mtm180 -145.71 59.23 1.26 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.454 -0.779 . . . . 0.0 109.897 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.451 ' C ' ' O ' ' A' ' 16' ' ' ARG . 38.4 t -36.24 122.08 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.572 -0.705 . . . . 0.0 110.555 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.471 HG22 ' N ' ' A' ' 19' ' ' GLY . 48.6 mt -77.13 170.77 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.398 -0.814 . . . . 0.0 110.152 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.471 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -58.93 -49.36 79.12 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.284 -1.527 . . . . 0.0 109.284 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 20' ' ' LEU . 16.6 tp -42.96 -40.05 2.84 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.439 -1.036 . . . . 0.0 110.231 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.455 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 68.9 m-85 -82.33 140.27 33.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.353 -0.842 . . . . 0.0 110.219 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.432 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 68.2 m80 -97.62 139.1 34.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.334 -0.854 . . . . 0.0 109.707 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 64.4 tttt -94.58 119.34 33.1 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.078 -1.014 . . . . 0.0 110.566 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.682 HD11 ' HD3' ' A' ' 35' ' ' LYS . 9.5 mt -90.59 -38.98 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 108.921 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.404 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -163.46 -163.72 16.9 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.45 HG22 ' N ' ' A' ' 27' ' ' CYS . 29.2 m -104.5 168.24 9.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.084 -1.245 . . . . 0.0 110.259 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.516 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 59.7 m -119.18 -171.67 2.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.38 -0.825 . . . . 0.0 109.824 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 55.1 t30 -93.77 153.65 18.19 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.192 -0.942 . . . . 0.0 110.469 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 1.8 t80 72.2 36.64 1.06 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.34 -0.85 . . . . 0.0 110.499 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 99.7 mtt180 60.27 52.11 5.1 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.356 -0.84 . . . . 0.0 111.055 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.516 ' CB ' ' HB2' ' A' ' 27' ' ' CYS . 25.0 m-85 -125.74 140.99 52.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.199 -0.938 . . . . 0.0 109.831 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.505 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 34.2 mmtp -87.9 156.79 19.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.065 -1.022 . . . . 0.0 109.597 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 27.6 t -102.63 123.2 45.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.229 -0.919 . . . . 0.0 109.866 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 50.6 m -141.63 154.17 45.21 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.149 -0.97 . . . . 0.0 110.577 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.682 ' HD3' HD11 ' A' ' 24' ' ' ILE . 53.1 mtpt -134.89 159.35 41.69 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.968 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -112.04 126.1 54.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.09 -1.006 . . . . 0.0 110.377 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.313 179.907 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' A' ' 1' ' ' ASN . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.249 0.547 . . . . 0.0 110.192 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 91.9 p -60.28 -35.87 76.54 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.234 -0.916 . . . . 0.0 109.905 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -125.5 150.47 47.36 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.886 . . . . 0.0 109.98 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -99.95 164.82 11.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.184 -0.947 . . . . 0.0 110.045 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -119.15 112.73 19.88 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.231 -0.918 . . . . 0.0 110.56 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.7 m -57.96 -24.25 57.2 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.397 -0.814 . . . . 0.0 109.762 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -60.96 -36.76 80.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 109.781 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -67.64 -40.22 84.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.361 -0.837 . . . . 0.0 109.889 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -65.73 -25.71 67.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.292 -0.88 . . . . 0.0 110.048 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.89 1.58 57.28 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.801 -1.319 . . . . 0.0 109.801 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.98 -172.01 7.62 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -130.54 143.91 51.06 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.199 -1.177 . . . . 0.0 110.256 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.868 ' C ' HD22 ' A' ' 14' ' ' LEU . 30.1 m -105.21 122.88 46.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.388 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.868 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.8 mm? -122.98 144.8 49.01 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.37 -0.831 . . . . 0.0 110.1 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -57.54 -19.27 24.02 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.171 -0.955 . . . . 0.0 110.011 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' A' ' 17' ' ' CYS . 32.5 ttm180 -168.62 72.96 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.359 -0.838 . . . . 0.0 109.863 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 61.2 m -40.03 147.91 0.09 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.513 -0.742 . . . . 0.0 110.54 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.534 HG22 ' N ' ' A' ' 19' ' ' GLY . 63.0 mt -84.47 173.84 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.344 -0.847 . . . . 0.0 109.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.534 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -53.73 -46.36 67.32 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.779 ' C ' HD13 ' A' ' 20' ' ' LEU . 3.4 tm? -51.12 -44.79 61.41 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.483 ' CE2' ' CD1' ' A' ' 36' ' ' PHE . 94.6 m-85 -76.39 149.52 36.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.889 . . . . 0.0 110.829 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.451 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.9 m-70 -114.25 143.56 44.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.357 -0.839 . . . . 0.0 109.665 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 39.8 ttpt -99.36 121.6 41.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.131 -0.98 . . . . 0.0 110.75 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.445 HD11 ' HB2' ' A' ' 35' ' ' LYS . 6.0 mt -85.77 -33.51 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.321 -0.862 . . . . 0.0 108.941 179.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -167.5 -131.91 1.34 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 108.907 -1.677 . . . . 0.0 108.907 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.5 m -130.19 163.41 26.73 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.134 -1.215 . . . . 0.0 110.207 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.522 ' O ' ' N ' ' A' ' 29' ' ' PHE . 1.1 t -94.87 -156.61 0.52 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 0.0 110.488 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.447 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 78.8 m-20 -64.99 56.84 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.762 -0.586 . . . . 0.0 111.021 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 88.3 t80 53.0 17.11 0.83 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.183 -0.948 . . . . 0.0 110.911 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 28' ' ' ASN . 97.1 mtt180 -125.87 -40.79 2.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.886 -1.133 . . . . 0.0 110.366 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.502 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 99.1 m-85 -128.16 170.05 13.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.224 -0.923 . . . . 0.0 110.077 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 74.6 mmtt -87.62 157.16 19.19 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.893 . . . . 0.0 109.927 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.48 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.8 t -94.35 110.77 22.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.305 -0.872 . . . . 0.0 109.954 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 99.3 m -129.42 163.95 24.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.38 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HB2' HD11 ' A' ' 24' ' ' ILE . 61.6 tttp -131.53 132.31 44.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.352 -0.843 . . . . 0.0 110.016 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.483 ' CD1' ' CE2' ' A' ' 21' ' ' PHE . 61.1 t80 -107.26 123.64 48.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.142 -0.974 . . . . 0.0 110.264 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 117.945 -1.026 . . . . 0.0 110.25 -179.863 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 62.0 t30 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.232 0.539 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 t -134.97 139.96 45.32 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.294 -0.878 . . . . 0.0 110.192 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -64.26 -35.92 82.41 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.347 -0.845 . . . . 0.0 110.154 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.519 ' CZ ' ' HB3' ' A' ' 9' ' ' GLU . 21.1 tpt180 -126.37 156.95 39.7 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.271 -0.893 . . . . 0.0 110.239 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.477 ' N ' ' HG3' ' A' ' 4' ' ' ARG . . . -132.82 104.45 6.6 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 110.262 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.6 t -60.53 -26.24 66.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.348 -0.845 . . . . 0.0 110.076 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -65.46 -35.68 81.64 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.297 -0.877 . . . . 0.0 110.162 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.1 mmm180 -99.7 -56.06 2.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.957 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.519 ' HB3' ' CZ ' ' A' ' 4' ' ' ARG . 20.7 mm-40 -80.97 -26.56 36.49 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.299 -0.876 . . . . 0.0 109.969 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.468 ' CA ' ' O ' ' A' ' 6' ' ' CYS . . . -89.41 9.07 78.37 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.45 ' HA3' ' O ' ' A' ' 34' ' ' CYS . . . 57.62 -117.2 9.42 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.476 ' HG3' ' CE1' ' A' ' 36' ' ' PHE . 95.5 mt-10 -120.07 145.28 47.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.257 -1.143 . . . . 0.0 110.317 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 85.4 m -93.99 125.44 38.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.272 -0.892 . . . . 0.0 109.673 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 14' ' ' LEU . 11.6 tp -128.47 164.86 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.489 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.577 ' CG ' ' CE1' ' A' ' 31' ' ' PHE . 90.9 mt-30 -73.75 -42.4 61.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.331 -0.855 . . . . 0.0 109.756 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.2 mtt-85 -122.37 63.14 0.95 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.36 -0.837 . . . . 0.0 109.48 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.469 ' C ' ' O ' ' A' ' 16' ' ' ARG . 45.3 t -34.54 118.45 0.4 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.395 0.617 . . . . 0.0 111.137 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.62 HD11 ' CD1' ' A' ' 21' ' ' PHE . 37.9 pt -59.25 168.64 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.325 -0.859 . . . . 0.0 109.999 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -77.2 -50.46 6.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.432 ' C ' ' O ' ' A' ' 19' ' ' GLY . 48.5 tp -40.91 -32.64 0.24 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.544 -0.974 . . . . 0.0 110.565 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.62 ' CD1' HD11 ' A' ' 18' ' ' ILE . 7.0 m-30 -91.99 115.48 28.11 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.442 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 62.6 t-80 -66.22 139.86 58.12 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.322 -0.861 . . . . 0.0 110.285 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 33' ' ' CYS . 39.5 ttpt -101.24 107.66 19.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.225 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.519 HG13 ' N ' ' A' ' 25' ' ' GLY . 32.3 pt -70.56 -27.48 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.27 -0.894 . . . . 0.0 109.965 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.519 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 177.7 -135.48 2.74 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -127.77 166.15 18.73 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.198 -1.178 . . . . 0.0 110.441 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 74.4 m -100.63 -176.96 3.34 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.655 -0.653 . . . . 0.0 109.684 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.491 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.3 t30 -80.67 52.04 1.61 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.009 -1.057 . . . . 0.0 109.52 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.491 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 79.5 t80 -179.91 176.91 0.71 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.691 -0.63 . . . . 0.0 109.893 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.433 ' N ' ' CG ' ' A' ' 29' ' ' PHE . 91.1 mmt-85 -53.59 -16.83 1.73 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.13 -0.981 . . . . 0.0 110.887 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 15' ' ' GLN . 7.1 m-30 -76.64 167.13 22.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.025 -1.047 . . . . 0.0 110.357 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 43.3 mmtm -120.32 161.37 21.26 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 110.195 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 83.1 m -86.35 133.66 33.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.138 -0.976 . . . . 0.0 110.409 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.45 ' O ' ' HA3' ' A' ' 11' ' ' GLY . 62.6 m -141.36 147.17 37.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.895 . . . . 0.0 110.305 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HD2' HG21 ' A' ' 24' ' ' ILE . 51.2 mtpt -107.93 127.86 54.12 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.348 -0.845 . . . . 0.0 110.287 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.612 ' HB2' ' CZ ' ' A' ' 21' ' ' PHE . 41.0 p90 -126.48 162.75 24.89 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.159 -0.963 . . . . 0.0 110.128 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.163 179.842 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 49.5 p-10 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.214 0.531 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 98.8 p -141.54 153.48 44.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.335 -0.853 . . . . 0.0 110.38 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.463 ' HD2' ' HG2' ' A' ' 9' ' ' GLU . 33.5 ttpt -112.82 155.9 23.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.342 -0.849 . . . . 0.0 110.088 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.672 ' O ' ' HB3' ' A' ' 5' ' ' ALA . 35.4 ttm180 -160.03 158.07 29.83 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.106 -0.996 . . . . 0.0 110.438 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.672 ' HB3' ' O ' ' A' ' 4' ' ' ARG . . . 66.14 104.86 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.255 -0.903 . . . . 0.0 110.358 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 t -61.0 -24.98 66.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.184 -0.947 . . . . 0.0 109.716 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -70.15 -29.37 66.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.399 -0.813 . . . . 0.0 109.711 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -67.79 -33.45 74.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.3 -0.875 . . . . 0.0 110.166 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.634 ' HB3' HD13 ' A' ' 24' ' ' ILE . 52.7 mt-10 -59.94 -26.58 66.08 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.263 -0.898 . . . . 0.0 110.269 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.76 -12.52 68.54 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.27 179.87 53.34 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.524 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 79.6 mm-40 -122.36 147.03 46.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.225 -1.162 . . . . 0.0 110.085 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.648 ' C ' HD22 ' A' ' 14' ' ' LEU . 74.9 m -86.16 124.22 32.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.21 -0.931 . . . . 0.0 110.106 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.765 HD22 ' N ' ' A' ' 14' ' ' LEU . 3.1 mm? -110.94 139.34 46.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.553 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.539 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 29.3 pt20 -65.28 -26.55 68.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.324 -0.86 . . . . 0.0 109.894 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' CYS . 76.3 mtm-85 -140.86 55.82 1.57 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.414 -0.804 . . . . 0.0 109.66 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' ARG . 15.9 t -38.69 143.86 0.13 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.574 -0.704 . . . . 0.0 110.589 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.581 HD12 HD12 ' A' ' 20' ' ' LEU . 40.4 pt -120.86 175.74 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.321 -0.862 . . . . 0.0 110.137 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -55.48 -48.13 72.1 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.581 HD12 HD12 ' A' ' 18' ' ' ILE . 94.9 mt -44.14 -37.55 3.18 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.445 -1.032 . . . . 0.0 110.223 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -99.16 116.7 31.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.385 -0.822 . . . . 0.0 110.443 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -71.55 136.71 47.59 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.942 . . . . 0.0 109.568 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.522 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 86.3 tttt -86.56 100.9 12.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.069 -1.02 . . . . 0.0 110.487 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.634 HD13 ' HB3' ' A' ' 9' ' ' GLU . 13.8 tt -63.03 -41.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.347 -0.846 . . . . 0.0 109.835 179.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.569 ' N ' HG23 ' A' ' 24' ' ' ILE . . . -158.63 -132.49 1.4 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.48 HG22 ' CE ' ' A' ' 23' ' ' LYS . 38.9 p -138.77 138.61 37.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -1.156 . . . . 0.0 110.047 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.487 ' HB3' ' O ' ' A' ' 31' ' ' PHE . 1.4 t -98.1 -159.64 0.75 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.167 -0.958 . . . . 0.0 109.64 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.525 ' OD1' ' N ' ' A' ' 31' ' ' PHE . 22.1 p30 -51.94 164.17 0.29 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.512 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -59.35 -12.62 6.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.98 -1.075 . . . . 0.0 111.346 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.605 ' HG3' ' CE1' ' A' ' 31' ' ' PHE . 46.7 tpt85 -98.78 -10.28 23.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.869 -1.144 . . . . 0.0 110.693 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.605 ' CE1' ' HG3' ' A' ' 30' ' ' ARG . 87.7 m-85 -144.38 154.63 43.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.959 -1.088 . . . . 0.0 110.647 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 87.3 mttt -106.91 155.22 19.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.444 ' HB2' ' C ' ' A' ' 25' ' ' GLY . 27.1 m -89.09 122.94 32.9 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.111 -0.993 . . . . 0.0 110.852 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.715 ' HB2' HD23 ' A' ' 14' ' ' LEU . 96.7 m -141.59 161.94 36.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.34 -0.85 . . . . 0.0 110.157 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -140.94 157.09 45.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.242 -0.911 . . . . 0.0 110.231 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.7 t80 -108.71 135.56 49.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.217 -0.927 . . . . 0.0 110.091 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.44 ' HG3' ' OXT' ' A' ' 37' ' ' GLN . 8.2 tp60 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.069 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.9 m120 . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.264 0.554 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.5 p -53.67 -32.0 49.85 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.177 -0.952 . . . . 0.0 110.041 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -84.44 141.04 31.1 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.297 -0.877 . . . . 0.0 110.011 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -69.82 160.17 32.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.26 -0.9 . . . . 0.0 110.577 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -110.77 115.74 30.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.352 -0.843 . . . . 0.0 110.36 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.0 t -57.49 -20.92 34.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.918 . . . . 0.0 110.139 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -69.92 -42.68 72.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.841 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -63.77 -34.24 77.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.374 -0.829 . . . . 0.0 109.944 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.415 ' OE1' ' SG ' ' A' ' 33' ' ' CYS . 97.7 mt-10 -64.37 -36.24 83.5 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.359 -0.838 . . . . 0.0 110.322 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.89 -4.58 28.96 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.21 -173.0 49.58 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -123.78 150.98 43.81 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.224 -1.162 . . . . 0.0 110.24 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.851 ' C ' HD22 ' A' ' 14' ' ' LEU . 25.7 m -92.78 116.17 28.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.207 -0.933 . . . . 0.0 110.311 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.851 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.2 mm? -121.37 132.89 55.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.209 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -53.54 -32.72 51.87 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.159 -0.963 . . . . 0.0 109.844 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 -150.89 64.72 0.92 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.348 -0.845 . . . . 0.0 110.25 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.512 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 19.3 p -55.16 168.77 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 110.402 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.541 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 41.4 pt -95.45 159.74 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.45 -0.781 . . . . 0.0 110.272 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.461 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -52.73 -45.87 60.13 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.541 ' HB2' ' CD1' ' A' ' 18' ' ' ILE . 9.9 mp -37.48 -36.02 0.15 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.858 -0.79 . . . . 0.0 110.451 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 8.7 m-30 -88.54 116.05 26.5 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.438 -0.789 . . . . 0.0 110.108 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.483 ' N ' ' O ' ' A' ' 35' ' ' LYS . 60.2 t-80 -68.64 141.95 55.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.046 -1.034 . . . . 0.0 109.95 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.2 ttmt -90.93 114.44 26.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.096 -1.002 . . . . 0.0 110.176 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.9 mt -78.15 -43.37 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.273 -0.892 . . . . 0.0 108.598 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.414 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -163.69 -141.7 3.2 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 43.0 p -131.18 154.83 47.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.249 -1.148 . . . . 0.0 110.361 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 64.8 m -83.88 -166.84 1.52 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.25 -0.906 . . . . 0.0 110.238 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.454 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 59.3 t30 -39.69 -49.51 2.26 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.529 -0.732 . . . . 0.0 110.736 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.454 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 89.6 t80 -178.83 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 111.025 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -66.48 -43.25 85.96 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.186 -0.946 . . . . 0.0 111.383 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.464 ' O ' ' HB2' ' A' ' 27' ' ' CYS . 93.3 m-85 -90.05 162.57 15.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.994 -1.067 . . . . 0.0 111.068 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 46.5 mttm -117.38 165.06 13.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.461 -0.774 . . . . 0.0 109.522 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 13.8 t -99.17 113.15 25.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.992 -1.068 . . . . 0.0 110.473 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.5 m -130.76 131.88 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.358 -0.839 . . . . 0.0 109.774 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 22' ' ' HIS . 80.9 tttt -134.98 155.66 50.38 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.233 -0.917 . . . . 0.0 110.573 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -95.14 137.11 34.63 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.332 -0.855 . . . . 0.0 110.068 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.291 179.931 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.3 m120 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.358 0.599 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.4 t -133.73 132.85 41.07 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.248 -0.908 . . . . 0.0 110.121 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -57.82 -32.94 68.09 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.16 -0.963 . . . . 0.0 110.022 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -117.92 156.71 27.98 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.347 -0.846 . . . . 0.0 110.088 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -105.07 114.8 29.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.22 -0.925 . . . . 0.0 110.273 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.1 t -60.99 -16.73 46.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -76.92 -40.08 48.47 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.221 -0.924 . . . . 0.0 109.717 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -60.25 -38.75 84.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.416 -0.803 . . . . 0.0 110.017 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.18 -37.12 84.84 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.273 -0.892 . . . . 0.0 110.079 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.08 21.1 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -86.16 -169.67 46.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -126.57 148.02 49.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.329 -1.101 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.663 ' C ' HD22 ' A' ' 14' ' ' LEU . 97.0 m -102.22 121.96 43.26 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.866 HD23 ' HB2' ' A' ' 34' ' ' CYS . 3.0 mm? -110.67 147.08 35.07 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.23 -0.918 . . . . 0.0 110.54 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.603 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 27.9 pt20 -75.07 -25.6 58.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -0.897 . . . . 0.0 109.936 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 17' ' ' CYS . 99.3 mtt180 -147.14 64.75 1.16 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.4 -0.812 . . . . 0.0 110.19 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 73.7 m -38.13 157.28 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.388 -0.82 . . . . 0.0 110.898 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 43.7 pt -127.38 172.67 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.393 -0.817 . . . . 0.0 109.943 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -46.84 -46.51 19.2 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.538 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 3.8 mm? -49.68 -36.23 24.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.518 -0.99 . . . . 0.0 110.703 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 53.2 m-85 -111.37 140.93 45.54 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.059 -179.122 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -112.93 134.25 54.53 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.33 -0.857 . . . . 0.0 109.353 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 34.9 ttpt -67.27 123.1 19.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.199 -0.938 . . . . 0.0 111.433 -178.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.2 mm -90.65 -35.38 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.438 ' C ' ' HB3' ' A' ' 33' ' ' CYS . . . -152.42 -133.17 1.9 Allowed Glycine 0 N--CA 1.486 1.997 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.412 HG22 ' N ' ' A' ' 27' ' ' CYS . 17.5 m -134.28 166.53 22.6 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.163 -1.198 . . . . 0.0 111.031 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 33' ' ' CYS . 91.2 m -143.29 -164.17 1.8 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.651 -0.656 . . . . 0.0 109.411 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.45 ' C ' ' O ' ' A' ' 27' ' ' CYS . 20.7 t-20 -40.53 155.45 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.804 . . . . 0.0 109.961 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -49.97 -35.48 24.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.16 -0.962 . . . . 0.0 111.017 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.41 ' NH1' ' OD1' ' A' ' 28' ' ' ASN . 91.8 mtm-85 -94.46 6.68 48.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.958 -1.089 . . . . 0.0 110.68 -179.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.603 ' CE1' ' HB3' ' A' ' 15' ' ' GLN . 95.9 m-85 -139.0 155.0 48.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.179 -0.951 . . . . 0.0 110.442 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.532 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 63.2 mttp -129.01 156.66 43.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.99 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.53 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 50.5 t -79.34 119.19 22.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.312 -0.868 . . . . 0.0 110.353 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.866 ' HB2' HD23 ' A' ' 14' ' ' LEU . 32.9 m -139.31 133.07 30.69 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 110.215 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -124.29 155.02 39.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.177 -0.952 . . . . 0.0 110.156 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -80.85 139.52 35.91 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.346 -0.846 . . . . 0.0 110.108 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 117.936 -1.031 . . . . 0.0 110.233 -179.943 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 63.4 t30 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.28 0.562 . . . . 0.0 110.186 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 t -54.64 -50.14 68.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.242 -0.911 . . . . 0.0 109.944 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -61.84 150.19 37.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.233 -0.917 . . . . 0.0 109.825 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -122.8 151.24 41.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.141 -0.974 . . . . 0.0 110.691 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 1.025 ' HB1' ' CE1' ' A' ' 7' ' ' TYR . . . -103.6 121.23 42.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.563 -0.711 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -76.42 -16.6 59.66 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.199 -0.938 . . . . 0.0 110.067 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 1.025 ' CE1' ' HB1' ' A' ' 5' ' ' ALA . 50.9 p90 -80.23 -46.53 16.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 0.0 109.895 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.636 ' HG3' ' CE2' ' A' ' 7' ' ' TYR . 57.4 mtt180 -49.78 -36.52 26.37 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.59 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -60.68 -37.84 82.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.424 -0.797 . . . . 0.0 109.927 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.94 4.46 55.53 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -82.69 -158.82 25.28 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.511 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 85.4 tt0 -143.41 135.29 26.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -1.171 . . . . 0.0 110.211 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.987 ' C ' HD22 ' A' ' 14' ' ' LEU . 89.2 m -83.1 136.26 34.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.159 -0.963 . . . . 0.0 110.119 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.987 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.3 mm? -127.87 134.69 49.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.146 -0.971 . . . . 0.0 110.358 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.541 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 15.2 pt20 -59.98 -24.63 64.6 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.338 -0.851 . . . . 0.0 110.353 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.427 ' O ' ' C ' ' A' ' 17' ' ' CYS . 89.2 mmt-85 -142.65 50.58 1.46 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 109.981 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.427 ' C ' ' O ' ' A' ' 16' ' ' ARG . 12.6 t -42.15 138.85 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.367 -0.833 . . . . 0.0 110.387 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.9 pt -108.62 176.78 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 110.077 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -53.47 -49.1 58.46 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 19' ' ' GLY . 15.7 tp -41.36 -29.87 0.16 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.505 -0.997 . . . . 0.0 110.425 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.96 113.75 26.73 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.279 -0.888 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.499 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 93.0 m-70 -67.83 148.45 51.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.237 -0.914 . . . . 0.0 109.521 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 33' ' ' CYS . 37.0 ttpt -110.6 111.79 23.24 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.173 -0.954 . . . . 0.0 110.786 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 7.0 mt -71.28 -41.85 74.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.205 -0.934 . . . . 0.0 108.587 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.75 -156.26 8.15 Favored Glycine 0 N--CA 1.488 2.153 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 54.5 p -116.5 142.56 46.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.135 -1.215 . . . . 0.0 109.883 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.425 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 72.8 m -87.5 179.96 6.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.946 . . . . 0.0 109.999 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 63.9 t30 -62.48 151.27 37.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.162 -0.961 . . . . 0.0 110.449 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.517 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.4 t80 71.41 -140.46 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.294 -0.879 . . . . 0.0 110.642 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -98.22 3.89 48.9 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.171 -0.956 . . . . 0.0 110.64 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.541 ' CE2' ' HB3' ' A' ' 15' ' ' GLN . 75.9 m-85 -81.24 140.79 34.69 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.093 -1.005 . . . . 0.0 110.431 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HD2' ' N ' ' A' ' 32' ' ' LYS . 11.4 mptt -100.07 161.35 13.66 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.204 -0.935 . . . . 0.0 110.282 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 84.1 m -99.84 123.82 44.5 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.313 -0.867 . . . . 0.0 109.853 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 54.9 m -130.19 163.65 26.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.097 -1.002 . . . . 0.0 110.609 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -127.83 133.4 49.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.252 -0.905 . . . . 0.0 110.424 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -88.8 138.6 31.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.866 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.292 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.231 0.539 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.8 m -119.98 149.19 42.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.245 -0.909 . . . . 0.0 110.306 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.65 -41.51 73.71 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.222 -0.924 . . . . 0.0 110.054 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -142.84 149.37 38.49 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.35 -0.844 . . . . 0.0 109.946 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.93 108.19 11.18 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.12 -0.987 . . . . 0.0 110.529 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.6 t -64.72 -22.88 67.08 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.221 -0.924 . . . . 0.0 109.771 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -62.98 -44.64 95.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.328 -0.857 . . . . 0.0 109.825 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.7 tpp180 -58.35 -41.08 83.9 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.343 -0.848 . . . . 0.0 109.995 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.62 ' OE1' HG21 ' A' ' 24' ' ' ILE . 93.5 mt-10 -63.79 -24.19 67.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.317 -0.864 . . . . 0.0 110.159 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.28 8.56 83.37 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.77 177.96 7.64 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.413 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 41.1 tt0 -116.71 127.41 54.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.182 -1.187 . . . . 0.0 110.07 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.601 ' C ' HD22 ' A' ' 14' ' ' LEU . 60.1 m -93.57 119.08 32.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.177 -0.952 . . . . 0.0 110.308 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.839 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.0 mm? -114.74 154.95 27.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.161 -0.962 . . . . 0.0 110.069 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.609 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 78.1 mt-30 -74.22 -17.24 60.91 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.25 -0.906 . . . . 0.0 110.021 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 15' ' ' GLN . 50.3 mtt180 -152.16 57.17 0.84 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.181 -0.949 . . . . 0.0 110.266 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 72.0 m -37.16 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.573 -0.704 . . . . 0.0 110.447 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.514 HG22 ' N ' ' A' ' 19' ' ' GLY . 72.3 mt -89.79 171.1 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.247 -0.908 . . . . 0.0 109.759 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.514 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -60.05 -45.49 95.85 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.41 ' HA ' HD12 ' A' ' 20' ' ' LEU . 29.0 tp -48.01 -43.64 30.11 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.611 -0.935 . . . . 0.0 110.951 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 66.8 m-85 -72.97 146.82 45.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.304 -0.873 . . . . 0.0 110.944 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.502 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 73.8 m80 -109.93 159.44 17.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.514 -0.741 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 60.6 tttm -94.99 108.32 20.38 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.03 -1.044 . . . . 0.0 110.7 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.62 HG21 ' OE1' ' A' ' 9' ' ' GLU . 20.7 mm -77.28 -42.19 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.885 . . . . 0.0 108.729 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.423 ' O ' ' NZ ' ' A' ' 23' ' ' LYS . . . -153.41 -129.28 1.36 Allowed Glycine 0 N--CA 1.486 2.027 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.5 p -141.39 155.37 45.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.11 -1.23 . . . . 0.0 110.482 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.451 ' O ' ' C ' ' A' ' 28' ' ' ASN . 97.4 m -123.16 -167.79 1.66 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.397 -0.814 . . . . 0.0 109.757 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.451 ' C ' ' O ' ' A' ' 27' ' ' CYS . 84.6 m-20 -39.57 147.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.607 -0.683 . . . . 0.0 110.169 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.408 ' C ' ' O ' ' A' ' 28' ' ' ASN . 78.7 t80 -42.39 -41.17 2.78 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -0.938 . . . . 0.0 110.792 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -85.24 4.35 35.15 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.114 -0.991 . . . . 0.0 110.853 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.609 ' CE2' ' CG ' ' A' ' 15' ' ' GLN . 96.0 m-85 -139.96 157.03 46.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.071 -1.018 . . . . 0.0 110.66 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.505 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 57.5 mttp -127.39 157.64 39.45 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.426 -0.797 . . . . 0.0 109.825 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 44.5 t -80.93 127.13 32.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.273 -0.892 . . . . 0.0 110.924 -179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.7 m -141.6 140.32 33.32 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.503 -0.748 . . . . 0.0 109.916 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -136.21 152.7 51.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.15 -0.969 . . . . 0.0 110.329 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.562 ' CE1' ' CZ ' ' A' ' 21' ' ' PHE . 67.5 m-85 -61.73 167.38 3.64 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.303 -0.873 . . . . 0.0 110.015 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.142 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 4' ' ' ARG . 83.7 m-20 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.248 0.547 . . . . 0.0 110.29 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.8 t -49.83 -47.4 51.54 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.16 -0.962 . . . . 0.0 110.182 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -60.3 -29.83 69.08 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.234 -0.916 . . . . 0.0 110.227 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 1' ' ' ASN . 64.1 mtp180 -74.83 161.31 29.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.247 -0.908 . . . . 0.0 109.981 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -113.82 114.35 26.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.149 -0.97 . . . . 0.0 110.462 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.6 m -61.57 -22.25 65.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.774 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -66.71 -44.02 82.76 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.388 -0.82 . . . . 0.0 109.975 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -59.75 -40.63 88.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.409 -0.807 . . . . 0.0 109.97 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' OE2' ' NH2' ' A' ' 4' ' ' ARG . 94.1 mt-10 -67.95 -27.62 66.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.338 -0.851 . . . . 0.0 110.152 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.04 11.07 59.15 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.18 -177.68 9.8 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -125.07 145.69 49.8 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.287 -1.125 . . . . 0.0 110.275 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.539 ' O ' HD23 ' A' ' 14' ' ' LEU . 84.8 m -124.46 131.0 53.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.361 -0.837 . . . . 0.0 110.141 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.539 HD23 ' O ' ' A' ' 13' ' ' CYS . 25.3 mt -120.02 146.08 46.21 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -55.66 -28.05 53.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.162 -0.961 . . . . 0.0 108.671 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.46 ' O ' HG13 ' A' ' 18' ' ' ILE . 99.1 mtt180 -135.71 63.58 1.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.45 ' C ' HG13 ' A' ' 18' ' ' ILE . 42.3 t -49.56 116.74 1.88 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.53 -0.731 . . . . 0.0 111.06 -179.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.593 HG22 ' N ' ' A' ' 19' ' ' GLY . 61.5 mt -151.26 172.68 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.414 -0.804 . . . . 0.0 109.499 179.22 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.593 ' N ' HG22 ' A' ' 18' ' ' ILE . . . 92.53 -162.02 26.53 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.4 mt -53.5 -19.96 4.31 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.388 -1.066 . . . . 0.0 110.474 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -75.57 145.45 41.21 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.282 -0.886 . . . . 0.0 110.365 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.435 ' CD2' HG12 ' A' ' 24' ' ' ILE . 35.2 p-80 -121.58 176.79 5.51 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.447 ' HE3' ' HD2' ' A' ' 32' ' ' LYS . 86.4 tttt -103.7 110.86 23.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.449 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 35' ' ' LYS . 7.1 mt -88.23 -34.85 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.85 . . . . 0.0 109.069 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.11 -163.25 21.73 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 m -94.15 165.69 12.49 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.026 -1.279 . . . . 0.0 110.614 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 31' ' ' PHE . 1.1 t -122.78 -158.55 0.79 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.379 -0.826 . . . . 0.0 110.183 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -71.95 151.75 43.04 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.649 -0.657 . . . . 0.0 110.565 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 8.9 t80 48.3 -124.88 1.83 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.473 -0.767 . . . . 0.0 110.778 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -104.92 14.52 29.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.882 -1.136 . . . . 0.0 111.197 -179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.429 ' O ' ' HB3' ' A' ' 27' ' ' CYS . 60.1 m-85 -84.07 142.55 30.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.012 -1.055 . . . . 0.0 110.189 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HD2' ' HE3' ' A' ' 23' ' ' LYS . 75.2 mmtt -90.07 159.16 16.96 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.28 -0.888 . . . . 0.0 110.65 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.46 ' HA ' ' SG ' ' A' ' 13' ' ' CYS . 16.8 t -89.6 131.81 35.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.309 -0.869 . . . . 0.0 109.985 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.406 ' SG ' ' O ' ' A' ' 22' ' ' HIS . 67.3 m -149.54 137.01 20.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.155 -0.966 . . . . 0.0 110.518 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.556 ' HB2' HD11 ' A' ' 24' ' ' ILE . 58.7 mtpt -125.96 157.8 36.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.451 -0.78 . . . . 0.0 110.024 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -95.51 132.43 40.62 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.245 -0.909 . . . . 0.0 110.29 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.216 179.932 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.3 m120 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.234 0.54 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 94.2 p -149.86 155.82 40.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.234 -0.916 . . . . 0.0 110.29 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -59.34 157.88 10.23 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.185 -0.947 . . . . 0.0 109.941 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.6 mtp180 -123.35 166.86 14.61 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.182 -0.949 . . . . 0.0 109.995 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.86 112.38 15.93 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 110.437 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 80.5 m -58.52 -23.09 57.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -68.75 -44.04 74.57 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.343 -0.848 . . . . 0.0 110.267 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -65.12 -41.84 94.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -0.928 . . . . 0.0 110.143 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.65 -29.48 68.07 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.158 -0.964 . . . . 0.0 110.093 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.85 3.74 68.0 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -74.47 -169.55 22.21 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 34' ' ' CYS . 87.9 mt-10 -133.2 149.08 52.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -1.091 . . . . 0.0 109.788 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.808 ' C ' HD22 ' A' ' 14' ' ' LEU . 72.9 m -109.9 129.95 55.59 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.05 -1.031 . . . . 0.0 110.446 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.815 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -118.98 145.65 45.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.355 -0.841 . . . . 0.0 110.191 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -63.13 -29.14 70.56 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.061 -1.024 . . . . 0.0 109.074 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.478 ' O ' ' C ' ' A' ' 17' ' ' CYS . 87.4 mtm180 -138.79 59.49 1.62 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.591 -0.693 . . . . 0.0 109.678 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.478 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.2 t -33.87 132.34 0.24 Allowed 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.5 0.667 . . . . 0.0 111.061 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.565 HG22 ' N ' ' A' ' 19' ' ' GLY . 75.5 mt -91.25 173.65 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.437 -0.789 . . . . 0.0 110.31 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.565 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -59.62 -50.89 62.85 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.695 ' C ' HD13 ' A' ' 20' ' ' LEU . 3.3 tm? -44.11 -45.53 8.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.4 -1.059 . . . . 0.0 110.045 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -80.04 135.7 36.41 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.421 -0.799 . . . . 0.0 109.995 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.438 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.5 m-70 -99.43 137.42 37.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.127 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.521 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 85.5 tttt -88.75 119.25 29.06 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.317 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.749 HD11 ' SG ' ' A' ' 33' ' ' CYS . 37.4 pt -86.16 -30.35 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.257 -0.902 . . . . 0.0 110.124 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.53 ' N ' HG13 ' A' ' 24' ' ' ILE . . . -168.23 -135.64 1.91 Allowed Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -121.22 140.43 52.04 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.239 -1.154 . . . . 0.0 110.523 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.472 ' HB2' ' C ' ' A' ' 32' ' ' LYS . 1.6 t -110.79 -161.6 0.76 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 27' ' ' CYS . 83.5 m-20 -46.23 141.99 3.12 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 119.693 -0.803 . . . . 0.0 109.447 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.98 -21.36 0.13 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.075 -1.015 . . . . 0.0 110.797 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.487 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 16.2 tpt180 -93.24 -3.64 53.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.003 -1.061 . . . . 0.0 110.424 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -148.11 157.01 43.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.854 -1.154 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.509 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 73.3 mmtt -101.88 158.34 16.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.365 -0.834 . . . . 0.0 109.69 179.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.749 ' SG ' HD11 ' A' ' 24' ' ' ILE . 7.0 t -85.85 115.07 23.27 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.143 -0.973 . . . . 0.0 110.421 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.491 ' O ' ' N ' ' A' ' 12' ' ' GLU . 85.0 m -131.96 142.57 49.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.356 -0.84 . . . . 0.0 110.07 179.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -123.72 129.1 50.57 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.989 . . . . 0.0 110.371 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -80.71 139.93 35.86 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.917 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.113 179.906 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASN . . . . . 0.442 ' O ' ' O ' ' A' ' 4' ' ' ARG . 82.9 m-20 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 121.321 0.581 . . . . 0.0 110.089 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 99.3 p -64.67 -29.08 70.07 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.352 -0.842 . . . . 0.0 110.361 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -66.94 -30.18 70.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.182 -0.949 . . . . 0.0 110.242 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.442 ' O ' ' O ' ' A' ' 1' ' ' ASN . 26.9 ptt-85 -144.85 141.1 28.83 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.308 -0.87 . . . . 0.0 110.03 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -112.28 110.63 20.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.293 -0.88 . . . . 0.0 110.424 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.5 t -59.54 -23.08 62.56 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.222 -0.924 . . . . 0.0 109.943 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -70.37 -40.18 74.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.257 -0.902 . . . . 0.0 110.004 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -66.63 -33.45 75.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.306 -0.871 . . . . 0.0 109.875 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -65.34 -34.54 78.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 19.78 78.09 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.61 -152.3 7.16 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -121.06 146.85 46.28 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -1.192 . . . . 0.0 109.836 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.861 ' C ' HD22 ' A' ' 14' ' ' LEU . 74.2 m -121.73 116.4 24.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.967 . . . . 0.0 110.367 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.861 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.9 mm? -120.93 147.32 45.6 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.321 -0.862 . . . . 0.0 109.764 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.438 ' OE1' ' HA ' ' A' ' 31' ' ' PHE . 16.2 mm-40 -54.78 -21.42 11.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.98 -1.075 . . . . 0.0 109.347 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -169.34 71.76 0.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.583 -0.698 . . . . 0.0 109.701 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 28.7 p -63.99 145.29 56.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.0 110.741 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 32.5 pt -141.1 159.23 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.641 -0.662 . . . . 0.0 110.153 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.57 -145.81 17.33 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.498 ' O ' ' CD2' ' A' ' 22' ' ' HIS . 26.3 mt -61.85 -16.18 48.2 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.399 -1.06 . . . . 0.0 110.228 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -72.59 135.34 45.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.339 -0.85 . . . . 0.0 111.028 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.515 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 94.6 m-70 -121.53 151.76 39.95 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.412 -0.805 . . . . 0.0 109.016 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.509 ' HE2' HG22 ' A' ' 26' ' ' THR . 60.2 tttm -93.54 126.64 38.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.868 -1.145 . . . . 0.0 111.66 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mt -101.49 -37.17 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.46 -148.59 5.17 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 43.5 p -136.31 149.0 48.23 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.072 -1.252 . . . . 0.0 110.469 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 8.1 m -115.69 163.91 15.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.355 -0.841 . . . . 0.0 109.732 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.52 ' O ' ' N ' ' A' ' 30' ' ' ARG . 54.8 t-20 38.98 29.72 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.432 -0.792 . . . . 0.0 110.692 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.486 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 85.1 t80 60.34 -74.75 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.437 -0.789 . . . . 0.0 110.509 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 28' ' ' ASN . 81.6 mtt180 -58.39 -49.35 77.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.2 -0.938 . . . . 0.0 110.513 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.438 ' HA ' ' OE1' ' A' ' 15' ' ' GLN . 90.5 m-85 -71.05 158.47 36.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.19 -0.943 . . . . 0.0 110.516 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 71.3 mmtt -108.58 168.35 9.4 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.0 t -107.0 133.87 51.0 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.185 -0.947 . . . . 0.0 109.787 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 96.1 m -140.52 134.69 30.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.453 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -110.79 148.65 31.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.354 -0.841 . . . . 0.0 110.401 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -81.87 145.21 30.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.223 -0.923 . . . . 0.0 109.925 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.489 ' OE1' ' CD2' ' A' ' 22' ' ' HIS . 61.6 tt0 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.263 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.247 0.546 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.6 m -64.23 -37.53 87.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.314 -0.866 . . . . 0.0 110.324 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -117.29 137.63 52.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.124 -0.985 . . . . 0.0 110.481 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.481 ' HD3' ' OE2' ' A' ' 9' ' ' GLU . 26.5 ttm180 -112.84 153.32 28.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.425 -0.797 . . . . 0.0 109.831 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.668 ' HB3' ' HD2' ' A' ' 8' ' ' ARG . . . -120.3 105.55 11.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.926 . . . . 0.0 110.212 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.9 t -52.75 -27.2 16.78 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -69.69 -33.68 72.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.363 -0.836 . . . . 0.0 110.129 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.668 ' HD2' ' HB3' ' A' ' 5' ' ' ALA . 79.8 mtt85 -73.95 -29.74 62.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.2 -0.938 . . . . 0.0 109.924 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.481 ' OE2' ' HD3' ' A' ' 4' ' ' ARG . 43.7 mt-10 -69.29 -24.42 63.95 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.72 4.52 36.71 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.425 ' CA ' ' HG2' ' A' ' 35' ' ' LYS . . . -86.78 -173.9 49.05 Favored Glycine 0 N--CA 1.49 2.233 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -124.96 142.8 51.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.21 -1.171 . . . . 0.0 110.224 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.789 ' C ' HD22 ' A' ' 14' ' ' LEU . 48.0 m -92.99 133.14 36.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.272 -0.892 . . . . 0.0 110.185 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.789 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.9 mm? -130.8 142.45 50.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.222 -0.924 . . . . 0.0 110.142 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.455 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 89.0 mt-30 -74.27 -21.68 59.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.294 -0.879 . . . . 0.0 110.569 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.424 ' O ' ' C ' ' A' ' 17' ' ' CYS . 92.1 mtt180 -148.83 62.01 1.06 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.108 -0.995 . . . . 0.0 110.639 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.492 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 92.5 m -41.86 144.18 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.159 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.41 HG22 ' HD1' ' A' ' 21' ' ' PHE . 16.8 tt -119.5 176.73 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.168 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.08 -45.21 26.68 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.403 ' HB2' HG23 ' A' ' 18' ' ' ILE . 99.5 mt -52.68 -29.47 26.75 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.608 -0.936 . . . . 0.0 110.652 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.485 ' CE2' ' HB2' ' A' ' 36' ' ' PHE . 87.9 m-85 -113.38 146.06 40.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.126 -0.984 . . . . 0.0 110.542 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.448 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.1 m-70 -106.87 134.12 50.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.736 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 39.0 ttpt -92.92 97.65 10.87 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.117 -0.989 . . . . 0.0 110.617 -179.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.601 HG23 ' N ' ' A' ' 25' ' ' GLY . 18.9 tt -64.41 -43.39 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.161 -0.962 . . . . 0.0 109.832 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.601 ' N ' HG23 ' A' ' 24' ' ' ILE . . . -155.17 -148.11 4.91 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.4 p -120.99 150.11 41.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.251 -1.147 . . . . 0.0 110.133 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 32' ' ' LYS . 92.4 m -77.68 -169.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 110.423 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.439 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 81.0 m-20 -51.71 -39.75 58.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.215 -0.928 . . . . 0.0 110.481 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.552 ' CD2' ' HB2' ' A' ' 30' ' ' ARG . 60.0 t80 -179.32 150.59 0.44 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.49 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.552 ' HB2' ' CD2' ' A' ' 29' ' ' PHE . 68.2 ttt180 66.16 -59.15 0.33 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.437 -0.789 . . . . 0.0 111.127 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.475 ' N ' ' O ' ' A' ' 29' ' ' PHE . 96.6 m-85 -79.48 157.12 27.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 0.0 110.647 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.497 ' HD2' ' CD ' ' A' ' 23' ' ' LYS . 50.3 mtmt -110.14 158.33 18.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.484 -0.76 . . . . 0.0 109.989 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.529 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 37.7 t -86.89 118.21 26.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.185 -0.947 . . . . 0.0 110.464 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 55.6 m -138.71 132.4 30.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.367 -0.833 . . . . 0.0 110.024 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HG2' ' CA ' ' A' ' 11' ' ' GLY . 98.6 mttt -113.37 139.81 48.57 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.295 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HB2' ' CE2' ' A' ' 21' ' ' PHE . 91.2 t80 -108.13 142.89 37.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.324 -0.86 . . . . 0.0 110.149 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.192 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 58.9 t30 . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.204 0.526 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.0 p -70.79 -36.87 73.21 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.328 -0.857 . . . . 0.0 110.099 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -137.41 160.89 37.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.209 -0.932 . . . . 0.0 109.968 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -84.66 158.65 20.76 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.24 -0.913 . . . . 0.0 110.334 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.71 115.28 27.65 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.289 -0.882 . . . . 0.0 110.038 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.536 ' CA ' ' HA3' ' A' ' 10' ' ' GLY . 59.5 m -71.9 -15.86 62.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -73.26 -29.64 62.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.293 -0.879 . . . . 0.0 110.444 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -83.89 -45.42 13.23 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.396 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -135.23 0.78 2.86 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.208 -0.932 . . . . 0.0 110.617 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.536 ' HA3' ' CA ' ' A' ' 6' ' ' CYS . . . -56.9 -23.2 44.63 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 72.15 -99.25 0.86 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -136.78 159.11 42.83 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -1.177 . . . . 0.0 110.303 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.49 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 57.7 m -120.24 150.04 41.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.21 -0.931 . . . . 0.0 110.655 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.719 HD12 ' H ' ' A' ' 15' ' ' GLN . 4.7 tp -148.45 160.28 43.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.351 -0.843 . . . . 0.0 109.872 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.719 ' H ' HD12 ' A' ' 14' ' ' LEU . 46.6 tt0 -69.22 -52.16 30.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.544 -0.723 . . . . 0.0 110.064 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -106.61 80.64 1.49 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.329 -0.857 . . . . 0.0 110.022 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.616 ' O ' HD13 ' A' ' 18' ' ' ILE . 7.2 t -77.11 81.07 3.63 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.616 HD13 ' O ' ' A' ' 17' ' ' CYS . 18.7 mm -136.85 166.84 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 110.487 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.414 ' N ' HG22 ' A' ' 18' ' ' ILE . . . 86.66 -128.06 8.7 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.406 ' HA ' HD12 ' A' ' 20' ' ' LEU . 23.7 tp -67.97 -32.17 72.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -1.141 . . . . 0.0 110.813 -179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 36' ' ' PHE . 90.7 m-85 -80.44 132.65 35.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.204 -0.935 . . . . 0.0 110.415 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -107.11 141.67 37.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.299 -0.875 . . . . 0.0 109.889 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.468 ' CD ' ' HD3' ' A' ' 32' ' ' LYS . 21.0 ttpt -89.42 114.01 25.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.142 -0.974 . . . . 0.0 110.473 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.411 HG13 ' HG3' ' A' ' 35' ' ' LYS . 22.7 mm -77.74 -41.89 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.309 -0.869 . . . . 0.0 108.761 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -164.12 -129.28 1.02 Allowed Glycine 0 N--CA 1.486 2.023 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 38.8 p -127.13 150.4 49.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.167 -1.196 . . . . 0.0 109.855 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.476 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -84.67 -160.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -0.997 . . . . 0.0 111.021 -179.62 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -62.48 -42.98 99.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.86 -0.525 . . . . 0.0 110.963 -179.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.565 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 81.7 t80 -177.08 143.98 0.42 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.17 -0.956 . . . . 0.0 110.543 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.538 ' O ' ' CD1' ' A' ' 31' ' ' PHE . 12.0 tpp180 52.33 19.63 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.284 -0.885 . . . . 0.0 110.255 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.565 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 47.9 m-85 -149.62 154.63 38.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 0.0 110.044 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.468 ' HD3' ' CD ' ' A' ' 23' ' ' LYS . 62.8 mttp -112.5 158.1 20.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.233 -0.917 . . . . 0.0 110.455 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.0 t -85.21 124.5 31.93 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.315 -0.866 . . . . 0.0 109.838 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 65.3 m -135.54 141.59 45.25 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.181 -0.95 . . . . 0.0 110.531 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.411 ' HG3' HG13 ' A' ' 24' ' ' ILE . 58.2 mtpt -116.59 127.31 54.37 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.31 -0.869 . . . . 0.0 109.909 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.401 ' CD1' ' CE1' ' A' ' 21' ' ' PHE . 92.2 t80 -98.41 139.72 33.74 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.173 -0.954 . . . . 0.0 110.562 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.085 179.747 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.274 0.559 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.418 ' O ' ' CD ' ' A' ' 9' ' ' GLU . 86.1 p -141.35 152.32 44.28 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.158 -0.964 . . . . 0.0 110.125 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 54.5 mttm -59.8 -38.02 80.77 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.23 -0.919 . . . . 0.0 110.333 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' A' ' 5' ' ' ALA . 27.1 mmm180 -64.8 158.28 25.37 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.264 -0.898 . . . . 0.0 110.187 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.873 ' HB1' ' CE2' ' A' ' 7' ' ' TYR . . . 54.67 95.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.308 -0.87 . . . . 0.0 109.767 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -74.73 -21.2 59.49 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.432 -0.792 . . . . 0.0 110.02 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.873 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 53.2 p90 -69.31 -44.73 71.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.413 -0.804 . . . . 0.0 109.647 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.63 ' N ' ' CD1' ' A' ' 7' ' ' TYR . 38.9 ttm180 -57.68 -42.66 84.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.37 -0.831 . . . . 0.0 109.906 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.442 ' OE1' HD13 ' A' ' 24' ' ' ILE . 41.6 mt-10 -67.02 -29.68 69.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.068 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.16 9.56 61.94 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.15 176.68 26.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -132.21 146.47 52.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.246 -1.15 . . . . 0.0 110.326 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.495 ' O ' HD23 ' A' ' 14' ' ' LEU . 79.1 m -103.57 130.76 51.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.255 -0.903 . . . . 0.0 109.95 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 13' ' ' CYS . 15.0 mt -112.32 141.58 45.87 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.148 -0.97 . . . . 0.0 110.499 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -56.64 -24.74 50.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 0.0 109.665 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.415 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.9 mtt-85 -137.91 55.12 1.78 Allowed 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.6 t -39.81 130.71 1.94 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.528 -0.733 . . . . 0.0 110.725 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.484 HG22 ' N ' ' A' ' 19' ' ' GLY . 40.7 mm -100.23 171.03 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.473 -0.767 . . . . 0.0 110.203 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.484 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -59.09 -46.41 93.8 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.403 ' C ' ' O ' ' A' ' 19' ' ' GLY . 34.0 tp -42.1 -37.92 1.54 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.607 -0.937 . . . . 0.0 110.179 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.457 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 88.4 m-85 -89.22 113.55 24.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.357 -0.839 . . . . 0.0 110.433 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.483 ' O ' ' N ' ' A' ' 35' ' ' LYS . 85.3 t60 -62.53 138.84 58.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.284 -0.885 . . . . 0.0 109.834 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -99.54 112.13 24.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 110.451 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.442 HD13 ' OE1' ' A' ' 9' ' ' GLU . 15.1 mt -72.63 -39.61 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.289 -0.882 . . . . 0.0 108.658 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.412 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -174.56 -129.7 1.21 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.8 p -120.22 155.8 32.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.209 -1.171 . . . . 0.0 110.028 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' PHE . 0.6 OUTLIER -94.59 -159.38 0.7 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -0.999 . . . . 0.0 110.438 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 43.9 t30 -43.09 -53.12 5.08 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.699 -0.625 . . . . 0.0 110.222 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.448 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 58.7 t80 -178.66 -61.84 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.49 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -68.8 -34.63 75.85 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.27 -0.894 . . . . 0.0 110.98 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.495 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 91.2 m-85 -103.51 156.11 18.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.018 -1.051 . . . . 0.0 110.591 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -102.7 159.25 15.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.389 -0.819 . . . . 0.0 109.936 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.412 ' HB3' ' H ' ' A' ' 25' ' ' GLY . 34.2 t -82.88 127.97 33.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.24 -0.913 . . . . 0.0 110.122 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 57.5 m -134.01 152.86 52.02 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.148 -0.97 . . . . 0.0 110.404 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.483 ' N ' ' O ' ' A' ' 22' ' ' HIS . 52.9 tttp -127.62 119.77 26.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.357 -0.839 . . . . 0.0 110.156 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -77.22 141.38 40.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.245 -0.91 . . . . 0.0 110.264 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.441 ' CG ' ' OXT' ' A' ' 37' ' ' GLN . 3.6 tt0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 117.934 -1.032 . . . . 0.0 110.167 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.213 0.53 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.95 -24.42 67.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.93 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -66.55 -43.86 83.94 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.888 . . . . 0.0 110.018 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -63.31 -35.22 79.65 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.295 -0.878 . . . . 0.0 109.981 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -66.19 -31.02 71.6 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 110.148 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.61 32.75 29.65 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.14 -172.01 48.5 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -117.76 147.69 42.75 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.268 -1.136 . . . . 0.0 110.294 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.714 ' C ' HD22 ' A' ' 14' ' ' LEU . 16.1 m -99.08 120.24 39.15 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.747 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -116.11 138.19 51.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.126 -0.984 . . . . 0.0 110.402 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.53 ' HG2' ' CE1' ' A' ' 31' ' ' PHE . 74.1 mt-30 -65.52 -27.51 68.52 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.347 -0.846 . . . . 0.0 109.915 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.7 mtm180 -141.33 58.49 1.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.413 -0.805 . . . . 0.0 110.101 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.442 ' C ' ' O ' ' A' ' 16' ' ' ARG . 19.1 t -38.58 124.57 1.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.482 -0.761 . . . . 0.0 110.823 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.581 HG22 ' N ' ' A' ' 19' ' ' GLY . 72.0 mt -91.59 173.93 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.051 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.581 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -56.88 -48.7 76.59 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.753 HD13 ' O ' ' A' ' 20' ' ' LEU . 3.1 tm? -40.81 -40.8 1.43 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.541 -0.976 . . . . 0.0 110.439 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 93.4 m-85 -88.39 118.71 28.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.43 -0.794 . . . . 0.0 110.497 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.487 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 97.2 m-70 -67.59 150.07 49.26 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.132 -0.98 . . . . 0.0 109.507 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -105.28 125.55 51.11 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.041 -1.037 . . . . 0.0 111.026 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.0 mm -100.76 -37.53 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 CA-C-O 121.737 0.78 . . . . 0.0 109.021 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -171.83 -150.42 7.17 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.325 -1.51 . . . . 0.0 109.325 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.2 p -119.15 160.2 22.55 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -1.219 . . . . 0.0 110.345 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 86.4 m -87.1 -164.92 1.16 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.219 -0.925 . . . . 0.0 110.627 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -64.92 -42.18 94.91 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.552 -0.718 . . . . 0.0 110.861 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.64 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 66.8 t80 -175.09 140.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -0.924 . . . . 0.0 110.473 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.64 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 38.4 mmt180 57.47 20.68 6.26 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.392 -0.818 . . . . 0.0 110.449 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.53 ' CE1' ' HG2' ' A' ' 15' ' ' GLN . 43.7 m-85 -148.12 152.43 37.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.187 -0.946 . . . . 0.0 110.113 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 27' ' ' CYS . 92.9 mttt -117.81 158.07 25.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.174 -0.954 . . . . 0.0 109.921 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.3 t -94.81 119.34 33.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 87.0 m -136.37 165.12 26.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.387 -0.821 . . . . 0.0 110.063 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -127.83 141.66 51.51 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -106.59 139.14 41.51 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.312 -0.867 . . . . 0.0 110.058 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.273 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.55 ' HB3' ' HE ' ' A' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.226 0.536 . . . . 0.0 110.45 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.5 t -59.39 -25.78 64.57 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.182 -0.948 . . . . 0.0 109.899 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -63.58 -41.89 98.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.295 -0.878 . . . . 0.0 110.114 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.55 ' HE ' ' HB3' ' A' ' 5' ' ' ALA . 53.6 mtm180 -75.17 -33.27 61.45 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.318 -0.864 . . . . 0.0 110.261 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -65.77 -25.78 67.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.317 -0.864 . . . . 0.0 110.116 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.96 12.83 73.3 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.2 165.21 13.01 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.423 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 68.4 mm-40 -100.92 141.61 33.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.302 -1.117 . . . . 0.0 110.255 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.7 m -100.19 129.87 46.26 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.168 -0.957 . . . . 0.0 110.436 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 14' ' ' LEU . 13.2 tp -124.44 166.67 15.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.085 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -79.23 -30.91 43.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.177 -0.952 . . . . 0.0 109.777 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 17' ' ' CYS . 34.0 ttm180 -146.66 76.33 1.43 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.0 109.312 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.437 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.8 t -36.08 126.07 0.75 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.431 0.634 . . . . 0.0 111.057 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.1 pt -95.95 178.82 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.338 -0.851 . . . . 0.0 110.253 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' A' ' 20' ' ' LEU . . . -56.9 -175.57 0.29 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 19' ' ' GLY . 60.0 mt 61.13 11.42 3.46 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -1.087 . . . . 0.0 110.332 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -135.78 131.0 34.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.0 110.505 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -99.34 142.09 31.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.421 -0.8 . . . . 0.0 109.481 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 84.7 tttt -95.72 112.04 23.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.055 -1.028 . . . . 0.0 111.166 -179.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.407 HD13 HG21 ' A' ' 24' ' ' ILE . 5.6 mt -87.99 -34.23 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.305 -0.872 . . . . 0.0 108.737 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.76 -156.68 8.33 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.5 p -123.61 156.33 36.0 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.198 -1.178 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.473 ' HB2' ' HB2' ' A' ' 31' ' ' PHE . 83.6 m -74.94 -166.7 0.5 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.375 -0.828 . . . . 0.0 110.427 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 47.4 t30 -71.64 -35.7 70.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.605 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.574 ' CE2' ' HG3' ' A' ' 30' ' ' ARG . 54.2 t80 179.64 144.96 0.18 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 110.141 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HG3' ' CE2' ' A' ' 29' ' ' PHE . 95.3 mtt180 57.18 19.01 4.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.408 -0.807 . . . . 0.0 110.972 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.473 ' HB2' ' HB2' ' A' ' 27' ' ' CYS . 44.1 m-85 -150.48 158.93 44.71 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.899 -1.125 . . . . 0.0 110.655 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.421 ' C ' ' SG ' ' A' ' 27' ' ' CYS . 35.6 mmtp -126.45 159.11 34.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.324 -0.86 . . . . 0.0 109.938 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 36.4 t -88.22 125.98 34.91 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.194 -0.941 . . . . 0.0 110.166 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 70.1 m -120.28 137.11 54.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 109.928 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -121.41 131.51 54.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.117 -0.99 . . . . 0.0 110.374 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 37' ' ' GLN . 62.2 t80 -103.45 128.17 50.67 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.473 ' HB3' ' O ' ' A' ' 36' ' ' PHE . 52.5 tt0 . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.271 0.558 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.1 t -63.19 -21.02 65.94 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.231 -0.918 . . . . 0.0 110.062 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -70.48 -37.38 74.24 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.924 . . . . 0.0 109.747 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttp85 -63.75 -37.18 86.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.482 -0.761 . . . . 0.0 109.946 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.508 ' CD ' HD12 ' A' ' 24' ' ' ILE . 52.1 mt-10 -69.06 -33.6 73.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.082 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.25 14.87 79.72 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.92 161.83 49.1 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.361 -1.496 . . . . 0.0 109.361 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.525 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 76.3 tt0 -101.97 139.95 36.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -1.202 . . . . 0.0 110.392 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.88 ' C ' HD22 ' A' ' 14' ' ' LEU . 67.6 m -84.71 130.87 34.64 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.36 -0.838 . . . . 0.0 110.13 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.88 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.0 mm? -124.54 135.32 53.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 110.3 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.99 -30.65 71.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.239 -0.913 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 17' ' ' CYS . 70.2 mtm180 -139.92 58.97 1.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.372 -0.83 . . . . 0.0 109.761 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.439 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.1 t -40.03 137.91 0.9 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.448 -0.783 . . . . 0.0 110.616 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 46.6 pt -114.14 179.53 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.363 -0.836 . . . . 0.0 110.499 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -54.5 -48.9 62.93 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 20' ' ' LEU . 15.5 tp -40.69 -41.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.649 -0.912 . . . . 0.0 110.45 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.488 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 90.1 m-85 -98.31 137.07 37.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.437 -0.789 . . . . 0.0 110.155 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -97.88 126.05 43.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.191 -0.943 . . . . 0.0 109.974 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.95 127.3 32.11 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.229 -0.919 . . . . 0.0 110.756 -179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.6 HG21 ' HB2' ' A' ' 35' ' ' LYS . 46.3 pt -103.44 -13.28 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.345 -0.847 . . . . 0.0 109.745 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.84 -136.78 3.74 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 3.1 m -138.16 157.61 45.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.097 -1.237 . . . . 0.0 110.227 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.448 ' O ' ' C ' ' A' ' 28' ' ' ASN . 72.8 m -93.7 -161.08 0.81 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.408 -0.808 . . . . 0.0 109.857 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.493 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.9 t30 -41.11 -46.56 3.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.521 -0.737 . . . . 0.0 110.149 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.493 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 92.3 t80 178.95 -63.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.397 -0.814 . . . . 0.0 110.816 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -61.99 -40.81 96.91 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.339 -0.85 . . . . 0.0 111.38 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.446 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 97.4 m-85 -96.01 164.27 12.78 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.067 -1.021 . . . . 0.0 111.492 -178.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.455 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 59.3 mttp -116.4 160.53 20.42 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.657 -0.652 . . . . 0.0 109.318 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 26' ' ' THR . 67.4 m -92.35 121.45 33.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.946 -1.096 . . . . 0.0 110.673 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.54 ' HB2' HD23 ' A' ' 14' ' ' LEU . 68.8 m -127.85 136.81 51.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.442 -0.786 . . . . 0.0 109.865 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.6 ' HB2' HG21 ' A' ' 24' ' ' ILE . 81.6 tttt -115.49 133.74 55.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.427 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -99.97 141.97 32.08 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.153 179.818 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.245 0.545 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.2 t -60.02 -23.26 63.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.959 . . . . 0.0 109.841 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -65.18 -37.7 88.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -62.53 -37.65 86.92 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.3 -0.875 . . . . 0.0 109.917 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.48 17.96 72.24 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -177.6 43.25 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -105.86 135.05 48.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.28 -1.13 . . . . 0.0 110.102 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.903 ' C ' HD22 ' A' ' 14' ' ' LEU . 87.9 m -92.91 130.52 38.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 110.239 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.903 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.2 mm? -132.09 143.64 50.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.386 -0.821 . . . . 0.0 110.119 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.539 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 11.2 pt20 -63.2 -33.22 75.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.213 -0.929 . . . . 0.0 109.428 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' A' ' 15' ' ' GLN . 78.8 mtt85 -158.4 61.97 0.44 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.601 -0.687 . . . . 0.0 109.714 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.598 ' O ' HG23 ' A' ' 18' ' ' ILE . 22.2 p -60.52 146.88 43.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.19 -0.944 . . . . 0.0 110.494 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.598 HG23 ' O ' ' A' ' 17' ' ' CYS . 29.5 pt -158.82 158.25 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.433 -0.792 . . . . 0.0 110.454 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.57 -119.75 4.98 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.6 mt -61.94 -23.16 66.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.31 -1.112 . . . . 0.0 110.554 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.438 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 80.0 m-85 -103.73 129.16 51.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.133 -0.98 . . . . 0.0 111.042 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.523 ' HB3' ' NE2' ' A' ' 37' ' ' GLN . 82.7 t60 -119.27 139.44 51.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.387 -0.82 . . . . 0.0 109.174 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -74.27 123.04 23.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.028 -1.045 . . . . 0.0 111.132 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.516 HG13 ' CG ' ' A' ' 35' ' ' LYS . 14.6 mm -93.38 -37.47 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -156.42 -143.49 3.68 Favored Glycine 0 N--CA 1.487 2.059 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 27.6 p -127.78 164.49 22.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.127 -1.219 . . . . 0.0 110.466 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.7 m -123.31 -176.96 3.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.243 -0.91 . . . . 0.0 110.125 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.512 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 51.6 t-20 -60.03 146.17 43.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 110.157 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.5 t80 70.98 -150.97 0.09 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.305 -0.872 . . . . 0.0 110.417 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -87.71 -5.4 58.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.255 -0.903 . . . . 0.0 110.732 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -72.09 138.9 48.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.183 -0.948 . . . . 0.0 110.234 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 94.2 mttt -103.18 164.93 11.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 13' ' ' CYS . 23.8 m -93.97 134.83 35.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 110.369 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.459 ' HB2' HD23 ' A' ' 14' ' ' LEU . 78.2 m -138.97 134.68 33.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.255 -0.903 . . . . 0.0 109.98 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.516 ' CG ' HG13 ' A' ' 24' ' ' ILE . 98.7 mttt -113.94 143.32 44.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.136 -0.978 . . . . 0.0 110.294 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 138.45 51.68 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 110.15 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.523 ' NE2' ' HB3' ' A' ' 22' ' ' HIS . 68.3 mt-30 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.251 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.473 0.654 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.9 m -54.55 -34.76 62.38 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.389 -0.82 . . . . 0.0 109.646 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -61.08 -42.63 98.86 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.519 -0.738 . . . . 0.0 109.847 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttt-85 -63.69 -35.49 80.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.44 -0.788 . . . . 0.0 110.235 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -71.39 -21.21 62.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 110.252 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.24 19.34 33.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -165.37 40.33 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 39.5 tp10 -135.88 148.49 48.64 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.242 -1.151 . . . . 0.0 110.178 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.774 ' C ' HD22 ' A' ' 14' ' ' LEU . 67.1 m -111.27 121.04 44.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.229 -0.919 . . . . 0.0 110.374 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.784 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -119.8 150.57 40.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.232 -0.918 . . . . 0.0 110.091 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -62.38 -35.2 78.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 0.0 109.699 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.772 ' O ' HG23 ' A' ' 18' ' ' ILE . 57.6 mtp180 -141.96 58.76 1.48 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.422 -0.799 . . . . 0.0 109.723 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 2.0 t -50.73 121.59 6.09 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.333 -0.855 . . . . 0.0 110.57 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.772 HG23 ' O ' ' A' ' 16' ' ' ARG . 25.9 pt -140.9 164.92 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.46 -0.775 . . . . 0.0 110.036 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.05 -151.71 17.61 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.5 mt -59.48 -17.99 36.16 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -1.167 . . . . 0.0 110.02 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -68.91 140.49 55.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.402 -0.811 . . . . 0.0 110.91 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 89.2 m-70 -114.63 162.51 16.68 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.316 -0.865 . . . . 0.0 109.413 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -91.48 111.96 23.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.929 -1.107 . . . . 0.0 110.848 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.4 mm -87.86 -35.19 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.06 -148.79 5.83 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 25.0 p -129.53 152.19 49.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.311 -1.111 . . . . 0.0 110.007 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.566 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 80.1 m -106.14 -174.75 2.61 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.109 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.522 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 93.3 m-20 -99.37 160.88 13.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.292 -0.88 . . . . 0.0 110.428 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.601 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 1.5 t80 71.16 39.03 1.0 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.28 -0.887 . . . . 0.0 110.271 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 95.5 mtt180 62.52 62.36 1.13 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 110.415 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.601 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 42.3 m-85 -145.68 155.06 42.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.218 -0.926 . . . . 0.0 110.055 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 48.2 mtmt -113.95 166.95 11.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.15 -0.969 . . . . 0.0 110.338 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.8 t -108.94 128.23 54.75 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 19.5 p -153.08 145.32 23.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.277 -0.889 . . . . 0.0 110.019 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -124.32 156.34 37.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.483 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -79.84 139.88 37.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.356 -0.84 . . . . 0.0 110.02 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.221 -179.802 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.469 ' HB3' ' HD2' ' A' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.425 0.631 . . . . 0.0 110.264 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.2 t -70.76 -28.57 64.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -59.7 -39.53 84.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.469 ' HD2' ' HB3' ' A' ' 5' ' ' ALA . 85.6 mtt180 -60.55 -42.27 96.21 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.314 -0.866 . . . . 0.0 110.116 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.295 -0.878 . . . . 0.0 110.019 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.38 -3.3 85.36 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.37 174.4 7.86 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 94.4 mt-10 -113.15 137.07 52.0 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.246 -1.15 . . . . 0.0 110.353 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.929 ' C ' HD22 ' A' ' 14' ' ' LEU . 15.7 m -85.39 124.09 31.59 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.28 -0.888 . . . . 0.0 109.99 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.929 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.3 mm? -124.57 146.15 49.2 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.13 -0.981 . . . . 0.0 110.161 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -63.74 -37.06 85.95 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.26 -0.9 . . . . 0.0 109.99 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 18' ' ' ILE . 37.2 ptt180 -137.01 58.12 1.73 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.23 -0.919 . . . . 0.0 109.607 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.577 ' C ' HG23 ' A' ' 18' ' ' ILE . 53.8 t -51.73 122.85 8.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.474 -0.766 . . . . 0.0 110.837 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.577 HG23 ' C ' ' A' ' 17' ' ' CYS . 19.4 pt -158.32 163.71 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.306 -0.871 . . . . 0.0 110.104 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.02 -145.62 16.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.73 -29.99 71.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.299 -1.118 . . . . 0.0 110.633 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 36' ' ' PHE . 95.5 m-85 -60.83 135.2 57.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.925 . . . . 0.0 110.422 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.46 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 98.0 m-70 -104.76 128.98 53.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.284 -0.885 . . . . 0.0 109.596 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.6 ttpt -81.32 115.76 20.84 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.144 -0.972 . . . . 0.0 110.828 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.668 HD11 ' HB2' ' A' ' 35' ' ' LYS . 11.1 mt -77.24 -47.4 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 108.868 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.41 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -158.79 -168.38 20.82 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.432 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 0.9 OUTLIER -94.08 158.33 15.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.071 -1.252 . . . . 0.0 110.154 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.547 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 57.4 m -85.07 -163.7 0.88 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.207 -0.933 . . . . 0.0 110.668 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 68.7 m-20 -63.18 -33.01 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 111.197 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.643 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 72.7 t80 -179.62 140.19 0.14 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.022 -1.049 . . . . 0.0 110.878 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.643 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 27.2 mmt85 49.03 25.4 1.09 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.277 -0.889 . . . . 0.0 110.658 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.547 ' CB ' ' HB2' ' A' ' 27' ' ' CYS . 33.6 m-85 -147.45 152.17 37.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.172 -0.955 . . . . 0.0 110.258 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.465 ' HE3' ' HB3' ' A' ' 17' ' ' CYS . 52.4 mtmt -115.41 155.31 27.65 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.931 . . . . 0.0 110.181 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 18.0 t -98.91 125.23 44.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.427 -0.795 . . . . 0.0 110.327 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.2 m -132.63 163.88 27.93 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.279 -0.888 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.668 ' HB2' HD11 ' A' ' 24' ' ' ILE . 87.8 tttt -131.93 140.56 49.06 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.365 -0.834 . . . . 0.0 109.97 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.563 ' HB3' ' CE1' ' A' ' 21' ' ' PHE . 44.6 p90 -123.64 161.43 25.06 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 110.256 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.409 -179.911 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.318 0.58 . . . . 0.0 109.92 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.81 -25.57 68.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.391 -0.818 . . . . 0.0 110.194 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -64.24 -38.93 92.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.357 -0.84 . . . . 0.0 110.078 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -57.82 -34.71 69.95 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.2 -0.937 . . . . 0.0 110.037 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -58.75 -29.23 66.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.235 -0.916 . . . . 0.0 110.109 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.85 10.76 34.2 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.54 -176.81 16.16 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.2 tp10 -110.01 130.28 55.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.258 -1.143 . . . . 0.0 109.952 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.914 ' C ' HD22 ' A' ' 14' ' ' LEU . 96.7 m -106.32 134.0 50.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.304 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.914 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.4 mm? -120.75 151.4 39.61 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.361 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -67.85 -24.91 65.31 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.373 -0.829 . . . . 0.0 109.619 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.451 ' O ' ' C ' ' A' ' 17' ' ' CYS . 81.3 mtm180 -145.71 59.23 1.26 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.454 -0.779 . . . . 0.0 109.897 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.451 ' C ' ' O ' ' A' ' 16' ' ' ARG . 38.4 t -36.24 122.08 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.572 -0.705 . . . . 0.0 110.555 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.471 HG22 ' N ' ' A' ' 19' ' ' GLY . 48.6 mt -77.13 170.77 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.398 -0.814 . . . . 0.0 110.152 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.471 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -58.93 -49.36 79.12 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.284 -1.527 . . . . 0.0 109.284 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 20' ' ' LEU . 16.6 tp -42.96 -40.05 2.84 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.439 -1.036 . . . . 0.0 110.231 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.455 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 68.9 m-85 -82.33 140.27 33.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.353 -0.842 . . . . 0.0 110.219 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.432 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 68.2 m80 -97.62 139.1 34.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.334 -0.854 . . . . 0.0 109.707 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 64.4 tttt -94.58 119.34 33.1 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.078 -1.014 . . . . 0.0 110.566 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.682 HD11 ' HD3' ' A' ' 35' ' ' LYS . 9.5 mt -90.59 -38.98 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 108.921 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.404 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -163.46 -163.72 16.9 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.45 HG22 ' N ' ' A' ' 27' ' ' CYS . 29.2 m -104.5 168.24 9.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.084 -1.245 . . . . 0.0 110.259 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.516 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 59.7 m -119.18 -171.67 2.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.38 -0.825 . . . . 0.0 109.824 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 55.1 t30 -93.77 153.65 18.19 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.192 -0.942 . . . . 0.0 110.469 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 1.8 t80 72.2 36.64 1.06 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.34 -0.85 . . . . 0.0 110.499 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 99.7 mtt180 60.27 52.11 5.1 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.356 -0.84 . . . . 0.0 111.055 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.516 ' CB ' ' HB2' ' A' ' 27' ' ' CYS . 25.0 m-85 -125.74 140.99 52.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.199 -0.938 . . . . 0.0 109.831 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.505 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 34.2 mmtp -87.9 156.79 19.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.065 -1.022 . . . . 0.0 109.597 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 27.6 t -102.63 123.2 45.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.229 -0.919 . . . . 0.0 109.866 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 50.6 m -141.63 154.17 45.21 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.149 -0.97 . . . . 0.0 110.577 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.682 ' HD3' HD11 ' A' ' 24' ' ' ILE . 53.1 mtpt -134.89 159.35 41.69 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.968 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -112.04 126.1 54.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.09 -1.006 . . . . 0.0 110.377 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.313 179.907 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.237 0.541 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.7 m -57.96 -24.25 57.2 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.397 -0.814 . . . . 0.0 109.762 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -60.96 -36.76 80.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 109.781 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -67.64 -40.22 84.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.361 -0.837 . . . . 0.0 109.889 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -65.73 -25.71 67.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.292 -0.88 . . . . 0.0 110.048 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.89 1.58 57.28 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.801 -1.319 . . . . 0.0 109.801 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.98 -172.01 7.62 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -130.54 143.91 51.06 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.199 -1.177 . . . . 0.0 110.256 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.868 ' C ' HD22 ' A' ' 14' ' ' LEU . 30.1 m -105.21 122.88 46.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.388 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.868 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.8 mm? -122.98 144.8 49.01 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.37 -0.831 . . . . 0.0 110.1 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -57.54 -19.27 24.02 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.171 -0.955 . . . . 0.0 110.011 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' A' ' 17' ' ' CYS . 32.5 ttm180 -168.62 72.96 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.359 -0.838 . . . . 0.0 109.863 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 61.2 m -40.03 147.91 0.09 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.513 -0.742 . . . . 0.0 110.54 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.534 HG22 ' N ' ' A' ' 19' ' ' GLY . 63.0 mt -84.47 173.84 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.344 -0.847 . . . . 0.0 109.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.534 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -53.73 -46.36 67.32 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.779 ' C ' HD13 ' A' ' 20' ' ' LEU . 3.4 tm? -51.12 -44.79 61.41 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.483 ' CE2' ' CD1' ' A' ' 36' ' ' PHE . 94.6 m-85 -76.39 149.52 36.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.889 . . . . 0.0 110.829 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.451 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.9 m-70 -114.25 143.56 44.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.357 -0.839 . . . . 0.0 109.665 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 39.8 ttpt -99.36 121.6 41.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.131 -0.98 . . . . 0.0 110.75 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.445 HD11 ' HB2' ' A' ' 35' ' ' LYS . 6.0 mt -85.77 -33.51 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.321 -0.862 . . . . 0.0 108.941 179.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -167.5 -131.91 1.34 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 108.907 -1.677 . . . . 0.0 108.907 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.5 m -130.19 163.41 26.73 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.134 -1.215 . . . . 0.0 110.207 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.522 ' O ' ' N ' ' A' ' 29' ' ' PHE . 1.1 t -94.87 -156.61 0.52 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 0.0 110.488 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.447 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 78.8 m-20 -64.99 56.84 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.762 -0.586 . . . . 0.0 111.021 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 88.3 t80 53.0 17.11 0.83 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.183 -0.948 . . . . 0.0 110.911 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 28' ' ' ASN . 97.1 mtt180 -125.87 -40.79 2.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.886 -1.133 . . . . 0.0 110.366 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.502 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 99.1 m-85 -128.16 170.05 13.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.224 -0.923 . . . . 0.0 110.077 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 74.6 mmtt -87.62 157.16 19.19 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.893 . . . . 0.0 109.927 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.48 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.8 t -94.35 110.77 22.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.305 -0.872 . . . . 0.0 109.954 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 99.3 m -129.42 163.95 24.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.38 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HB2' HD11 ' A' ' 24' ' ' ILE . 61.6 tttp -131.53 132.31 44.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.352 -0.843 . . . . 0.0 110.016 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.483 ' CD1' ' CE2' ' A' ' 21' ' ' PHE . 61.1 t80 -107.26 123.64 48.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.142 -0.974 . . . . 0.0 110.264 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 117.945 -1.026 . . . . 0.0 110.25 -179.863 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.203 0.525 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.6 t -60.53 -26.24 66.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.348 -0.845 . . . . 0.0 110.076 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -65.46 -35.68 81.64 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.297 -0.877 . . . . 0.0 110.162 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.1 mmm180 -99.7 -56.06 2.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.957 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -80.97 -26.56 36.49 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.299 -0.876 . . . . 0.0 109.969 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.468 ' CA ' ' O ' ' A' ' 6' ' ' CYS . . . -89.41 9.07 78.37 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.45 ' HA3' ' O ' ' A' ' 34' ' ' CYS . . . 57.62 -117.2 9.42 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.476 ' HG3' ' CE1' ' A' ' 36' ' ' PHE . 95.5 mt-10 -120.07 145.28 47.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.257 -1.143 . . . . 0.0 110.317 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 85.4 m -93.99 125.44 38.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.272 -0.892 . . . . 0.0 109.673 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 14' ' ' LEU . 11.6 tp -128.47 164.86 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.489 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.577 ' CG ' ' CE1' ' A' ' 31' ' ' PHE . 90.9 mt-30 -73.75 -42.4 61.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.331 -0.855 . . . . 0.0 109.756 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.2 mtt-85 -122.37 63.14 0.95 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.36 -0.837 . . . . 0.0 109.48 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.469 ' C ' ' O ' ' A' ' 16' ' ' ARG . 45.3 t -34.54 118.45 0.4 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.395 0.617 . . . . 0.0 111.137 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.62 HD11 ' CD1' ' A' ' 21' ' ' PHE . 37.9 pt -59.25 168.64 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.325 -0.859 . . . . 0.0 109.999 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -77.2 -50.46 6.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.432 ' C ' ' O ' ' A' ' 19' ' ' GLY . 48.5 tp -40.91 -32.64 0.24 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.544 -0.974 . . . . 0.0 110.565 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.62 ' CD1' HD11 ' A' ' 18' ' ' ILE . 7.0 m-30 -91.99 115.48 28.11 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.442 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 62.6 t-80 -66.22 139.86 58.12 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.322 -0.861 . . . . 0.0 110.285 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 33' ' ' CYS . 39.5 ttpt -101.24 107.66 19.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.225 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.519 HG13 ' N ' ' A' ' 25' ' ' GLY . 32.3 pt -70.56 -27.48 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.27 -0.894 . . . . 0.0 109.965 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.519 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 177.7 -135.48 2.74 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -127.77 166.15 18.73 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.198 -1.178 . . . . 0.0 110.441 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 74.4 m -100.63 -176.96 3.34 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.655 -0.653 . . . . 0.0 109.684 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.491 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.3 t30 -80.67 52.04 1.61 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.009 -1.057 . . . . 0.0 109.52 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.491 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 79.5 t80 -179.91 176.91 0.71 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.691 -0.63 . . . . 0.0 109.893 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.433 ' N ' ' CG ' ' A' ' 29' ' ' PHE . 91.1 mmt-85 -53.59 -16.83 1.73 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.13 -0.981 . . . . 0.0 110.887 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 15' ' ' GLN . 7.1 m-30 -76.64 167.13 22.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.025 -1.047 . . . . 0.0 110.357 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 43.3 mmtm -120.32 161.37 21.26 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 110.195 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 83.1 m -86.35 133.66 33.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.138 -0.976 . . . . 0.0 110.409 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.45 ' O ' ' HA3' ' A' ' 11' ' ' GLY . 62.6 m -141.36 147.17 37.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.895 . . . . 0.0 110.305 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HD2' HG21 ' A' ' 24' ' ' ILE . 51.2 mtpt -107.93 127.86 54.12 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.348 -0.845 . . . . 0.0 110.287 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.612 ' HB2' ' CZ ' ' A' ' 21' ' ' PHE . 41.0 p90 -126.48 162.75 24.89 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.159 -0.963 . . . . 0.0 110.128 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.163 179.842 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.293 0.568 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 t -61.0 -24.98 66.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.184 -0.947 . . . . 0.0 109.716 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -70.15 -29.37 66.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.399 -0.813 . . . . 0.0 109.711 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -67.79 -33.45 74.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.3 -0.875 . . . . 0.0 110.166 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.634 ' HB3' HD13 ' A' ' 24' ' ' ILE . 52.7 mt-10 -59.94 -26.58 66.08 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.263 -0.898 . . . . 0.0 110.269 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.76 -12.52 68.54 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.27 179.87 53.34 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.524 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 79.6 mm-40 -122.36 147.03 46.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.225 -1.162 . . . . 0.0 110.085 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.648 ' C ' HD22 ' A' ' 14' ' ' LEU . 74.9 m -86.16 124.22 32.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.21 -0.931 . . . . 0.0 110.106 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.765 HD22 ' N ' ' A' ' 14' ' ' LEU . 3.1 mm? -110.94 139.34 46.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.553 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.539 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 29.3 pt20 -65.28 -26.55 68.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.324 -0.86 . . . . 0.0 109.894 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' CYS . 76.3 mtm-85 -140.86 55.82 1.57 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.414 -0.804 . . . . 0.0 109.66 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' ARG . 15.9 t -38.69 143.86 0.13 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.574 -0.704 . . . . 0.0 110.589 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.581 HD12 HD12 ' A' ' 20' ' ' LEU . 40.4 pt -120.86 175.74 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.321 -0.862 . . . . 0.0 110.137 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -55.48 -48.13 72.1 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.581 HD12 HD12 ' A' ' 18' ' ' ILE . 94.9 mt -44.14 -37.55 3.18 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.445 -1.032 . . . . 0.0 110.223 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -99.16 116.7 31.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.385 -0.822 . . . . 0.0 110.443 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -71.55 136.71 47.59 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.942 . . . . 0.0 109.568 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.522 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 86.3 tttt -86.56 100.9 12.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.069 -1.02 . . . . 0.0 110.487 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.634 HD13 ' HB3' ' A' ' 9' ' ' GLU . 13.8 tt -63.03 -41.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.347 -0.846 . . . . 0.0 109.835 179.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.569 ' N ' HG23 ' A' ' 24' ' ' ILE . . . -158.63 -132.49 1.4 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.48 HG22 ' CE ' ' A' ' 23' ' ' LYS . 38.9 p -138.77 138.61 37.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -1.156 . . . . 0.0 110.047 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.487 ' HB3' ' O ' ' A' ' 31' ' ' PHE . 1.4 t -98.1 -159.64 0.75 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.167 -0.958 . . . . 0.0 109.64 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.525 ' OD1' ' N ' ' A' ' 31' ' ' PHE . 22.1 p30 -51.94 164.17 0.29 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.512 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -59.35 -12.62 6.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.98 -1.075 . . . . 0.0 111.346 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.605 ' HG3' ' CE1' ' A' ' 31' ' ' PHE . 46.7 tpt85 -98.78 -10.28 23.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.869 -1.144 . . . . 0.0 110.693 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.605 ' CE1' ' HG3' ' A' ' 30' ' ' ARG . 87.7 m-85 -144.38 154.63 43.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.959 -1.088 . . . . 0.0 110.647 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 87.3 mttt -106.91 155.22 19.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.444 ' HB2' ' C ' ' A' ' 25' ' ' GLY . 27.1 m -89.09 122.94 32.9 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.111 -0.993 . . . . 0.0 110.852 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.715 ' HB2' HD23 ' A' ' 14' ' ' LEU . 96.7 m -141.59 161.94 36.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.34 -0.85 . . . . 0.0 110.157 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -140.94 157.09 45.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.242 -0.911 . . . . 0.0 110.231 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.7 t80 -108.71 135.56 49.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.217 -0.927 . . . . 0.0 110.091 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.44 ' HG3' ' OXT' ' A' ' 37' ' ' GLN . 8.2 tp60 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.069 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.296 0.57 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.0 t -57.49 -20.92 34.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.918 . . . . 0.0 110.139 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -69.92 -42.68 72.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.841 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -63.77 -34.24 77.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.374 -0.829 . . . . 0.0 109.944 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.415 ' OE1' ' SG ' ' A' ' 33' ' ' CYS . 97.7 mt-10 -64.37 -36.24 83.5 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.359 -0.838 . . . . 0.0 110.322 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.89 -4.58 28.96 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.21 -173.0 49.58 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -123.78 150.98 43.81 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.224 -1.162 . . . . 0.0 110.24 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.851 ' C ' HD22 ' A' ' 14' ' ' LEU . 25.7 m -92.78 116.17 28.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.207 -0.933 . . . . 0.0 110.311 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.851 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.2 mm? -121.37 132.89 55.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.209 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -53.54 -32.72 51.87 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.159 -0.963 . . . . 0.0 109.844 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 -150.89 64.72 0.92 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.348 -0.845 . . . . 0.0 110.25 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.512 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 19.3 p -55.16 168.77 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 110.402 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.541 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 41.4 pt -95.45 159.74 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.45 -0.781 . . . . 0.0 110.272 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.461 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -52.73 -45.87 60.13 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.541 ' HB2' ' CD1' ' A' ' 18' ' ' ILE . 9.9 mp -37.48 -36.02 0.15 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.858 -0.79 . . . . 0.0 110.451 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 8.7 m-30 -88.54 116.05 26.5 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.438 -0.789 . . . . 0.0 110.108 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.483 ' N ' ' O ' ' A' ' 35' ' ' LYS . 60.2 t-80 -68.64 141.95 55.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.046 -1.034 . . . . 0.0 109.95 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.2 ttmt -90.93 114.44 26.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.096 -1.002 . . . . 0.0 110.176 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.9 mt -78.15 -43.37 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.273 -0.892 . . . . 0.0 108.598 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.414 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -163.69 -141.7 3.2 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 43.0 p -131.18 154.83 47.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.249 -1.148 . . . . 0.0 110.361 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 64.8 m -83.88 -166.84 1.52 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.25 -0.906 . . . . 0.0 110.238 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.454 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 59.3 t30 -39.69 -49.51 2.26 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.529 -0.732 . . . . 0.0 110.736 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.454 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 89.6 t80 -178.83 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 111.025 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -66.48 -43.25 85.96 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.186 -0.946 . . . . 0.0 111.383 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.464 ' O ' ' HB2' ' A' ' 27' ' ' CYS . 93.3 m-85 -90.05 162.57 15.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.994 -1.067 . . . . 0.0 111.068 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 46.5 mttm -117.38 165.06 13.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.461 -0.774 . . . . 0.0 109.522 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 13.8 t -99.17 113.15 25.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.992 -1.068 . . . . 0.0 110.473 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.5 m -130.76 131.88 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.358 -0.839 . . . . 0.0 109.774 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 22' ' ' HIS . 80.9 tttt -134.98 155.66 50.38 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.233 -0.917 . . . . 0.0 110.573 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -95.14 137.11 34.63 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.332 -0.855 . . . . 0.0 110.068 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.291 179.931 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.149 0.5 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.1 t -60.99 -16.73 46.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -76.92 -40.08 48.47 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.221 -0.924 . . . . 0.0 109.717 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -60.25 -38.75 84.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.416 -0.803 . . . . 0.0 110.017 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.18 -37.12 84.84 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.273 -0.892 . . . . 0.0 110.079 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.08 21.1 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -86.16 -169.67 46.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -126.57 148.02 49.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.329 -1.101 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.663 ' C ' HD22 ' A' ' 14' ' ' LEU . 97.0 m -102.22 121.96 43.26 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.866 HD23 ' HB2' ' A' ' 34' ' ' CYS . 3.0 mm? -110.67 147.08 35.07 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.23 -0.918 . . . . 0.0 110.54 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.603 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 27.9 pt20 -75.07 -25.6 58.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -0.897 . . . . 0.0 109.936 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 17' ' ' CYS . 99.3 mtt180 -147.14 64.75 1.16 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.4 -0.812 . . . . 0.0 110.19 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 73.7 m -38.13 157.28 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.388 -0.82 . . . . 0.0 110.898 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 43.7 pt -127.38 172.67 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.393 -0.817 . . . . 0.0 109.943 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -46.84 -46.51 19.2 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.538 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 3.8 mm? -49.68 -36.23 24.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.518 -0.99 . . . . 0.0 110.703 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 53.2 m-85 -111.37 140.93 45.54 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.059 -179.122 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -112.93 134.25 54.53 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.33 -0.857 . . . . 0.0 109.353 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 34.9 ttpt -67.27 123.1 19.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.199 -0.938 . . . . 0.0 111.433 -178.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.2 mm -90.65 -35.38 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.438 ' C ' ' HB3' ' A' ' 33' ' ' CYS . . . -152.42 -133.17 1.9 Allowed Glycine 0 N--CA 1.486 1.997 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.412 HG22 ' N ' ' A' ' 27' ' ' CYS . 17.5 m -134.28 166.53 22.6 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.163 -1.198 . . . . 0.0 111.031 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 33' ' ' CYS . 91.2 m -143.29 -164.17 1.8 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.651 -0.656 . . . . 0.0 109.411 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.45 ' C ' ' O ' ' A' ' 27' ' ' CYS . 20.7 t-20 -40.53 155.45 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.804 . . . . 0.0 109.961 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -49.97 -35.48 24.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.16 -0.962 . . . . 0.0 111.017 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.41 ' NH1' ' OD1' ' A' ' 28' ' ' ASN . 91.8 mtm-85 -94.46 6.68 48.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.958 -1.089 . . . . 0.0 110.68 -179.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.603 ' CE1' ' HB3' ' A' ' 15' ' ' GLN . 95.9 m-85 -139.0 155.0 48.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.179 -0.951 . . . . 0.0 110.442 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.532 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 63.2 mttp -129.01 156.66 43.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.99 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.53 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 50.5 t -79.34 119.19 22.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.312 -0.868 . . . . 0.0 110.353 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.866 ' HB2' HD23 ' A' ' 14' ' ' LEU . 32.9 m -139.31 133.07 30.69 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 110.215 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -124.29 155.02 39.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.177 -0.952 . . . . 0.0 110.156 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -80.85 139.52 35.91 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.346 -0.846 . . . . 0.0 110.108 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 117.936 -1.031 . . . . 0.0 110.233 -179.943 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 1.025 ' HB1' ' CE1' ' A' ' 7' ' ' TYR . . . . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.277 0.56 . . . . 0.0 110.137 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -76.42 -16.6 59.66 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.199 -0.938 . . . . 0.0 110.067 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 1.025 ' CE1' ' HB1' ' A' ' 5' ' ' ALA . 50.9 p90 -80.23 -46.53 16.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 0.0 109.895 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.636 ' HG3' ' CE2' ' A' ' 7' ' ' TYR . 57.4 mtt180 -49.78 -36.52 26.37 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.59 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -60.68 -37.84 82.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.424 -0.797 . . . . 0.0 109.927 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.94 4.46 55.53 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -82.69 -158.82 25.28 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.511 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 85.4 tt0 -143.41 135.29 26.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -1.171 . . . . 0.0 110.211 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.987 ' C ' HD22 ' A' ' 14' ' ' LEU . 89.2 m -83.1 136.26 34.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.159 -0.963 . . . . 0.0 110.119 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.987 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.3 mm? -127.87 134.69 49.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.146 -0.971 . . . . 0.0 110.358 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.541 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 15.2 pt20 -59.98 -24.63 64.6 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.338 -0.851 . . . . 0.0 110.353 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.427 ' O ' ' C ' ' A' ' 17' ' ' CYS . 89.2 mmt-85 -142.65 50.58 1.46 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 109.981 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.427 ' C ' ' O ' ' A' ' 16' ' ' ARG . 12.6 t -42.15 138.85 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.367 -0.833 . . . . 0.0 110.387 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.9 pt -108.62 176.78 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 110.077 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -53.47 -49.1 58.46 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 19' ' ' GLY . 15.7 tp -41.36 -29.87 0.16 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.505 -0.997 . . . . 0.0 110.425 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.96 113.75 26.73 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.279 -0.888 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.499 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 93.0 m-70 -67.83 148.45 51.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.237 -0.914 . . . . 0.0 109.521 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 33' ' ' CYS . 37.0 ttpt -110.6 111.79 23.24 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.173 -0.954 . . . . 0.0 110.786 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 7.0 mt -71.28 -41.85 74.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.205 -0.934 . . . . 0.0 108.587 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.75 -156.26 8.15 Favored Glycine 0 N--CA 1.488 2.153 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 54.5 p -116.5 142.56 46.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.135 -1.215 . . . . 0.0 109.883 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.425 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 72.8 m -87.5 179.96 6.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.946 . . . . 0.0 109.999 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 63.9 t30 -62.48 151.27 37.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.162 -0.961 . . . . 0.0 110.449 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.517 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.4 t80 71.41 -140.46 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.294 -0.879 . . . . 0.0 110.642 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -98.22 3.89 48.9 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.171 -0.956 . . . . 0.0 110.64 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.541 ' CE2' ' HB3' ' A' ' 15' ' ' GLN . 75.9 m-85 -81.24 140.79 34.69 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.093 -1.005 . . . . 0.0 110.431 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HD2' ' N ' ' A' ' 32' ' ' LYS . 11.4 mptt -100.07 161.35 13.66 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.204 -0.935 . . . . 0.0 110.282 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 84.1 m -99.84 123.82 44.5 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.313 -0.867 . . . . 0.0 109.853 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 54.9 m -130.19 163.65 26.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.097 -1.002 . . . . 0.0 110.609 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -127.83 133.4 49.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.252 -0.905 . . . . 0.0 110.424 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -88.8 138.6 31.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.866 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.292 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.237 0.541 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.6 t -64.72 -22.88 67.08 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.221 -0.924 . . . . 0.0 109.771 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -62.98 -44.64 95.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.328 -0.857 . . . . 0.0 109.825 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.7 tpp180 -58.35 -41.08 83.9 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.343 -0.848 . . . . 0.0 109.995 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.62 ' OE1' HG21 ' A' ' 24' ' ' ILE . 93.5 mt-10 -63.79 -24.19 67.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.317 -0.864 . . . . 0.0 110.159 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.28 8.56 83.37 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.77 177.96 7.64 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.413 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 41.1 tt0 -116.71 127.41 54.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.182 -1.187 . . . . 0.0 110.07 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.601 ' C ' HD22 ' A' ' 14' ' ' LEU . 60.1 m -93.57 119.08 32.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.177 -0.952 . . . . 0.0 110.308 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.839 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.0 mm? -114.74 154.95 27.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.161 -0.962 . . . . 0.0 110.069 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.609 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 30.4 mt-30 -74.22 -17.24 60.91 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.25 -0.906 . . . . 0.0 110.021 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 15' ' ' GLN . 50.3 mtt180 -152.16 57.17 0.84 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.181 -0.949 . . . . 0.0 110.266 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 72.0 m -37.16 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.573 -0.704 . . . . 0.0 110.447 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.514 HG22 ' N ' ' A' ' 19' ' ' GLY . 72.3 mt -89.79 171.1 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.247 -0.908 . . . . 0.0 109.759 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.514 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -60.05 -45.49 95.85 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.41 ' HA ' HD12 ' A' ' 20' ' ' LEU . 29.0 tp -48.01 -43.64 30.11 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.611 -0.935 . . . . 0.0 110.951 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 66.8 m-85 -72.97 146.82 45.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.304 -0.873 . . . . 0.0 110.944 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.502 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 73.8 m80 -109.93 159.44 17.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.514 -0.741 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 60.6 tttm -94.99 108.32 20.38 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.03 -1.044 . . . . 0.0 110.7 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.62 HG21 ' OE1' ' A' ' 9' ' ' GLU . 20.7 mm -77.28 -42.19 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.885 . . . . 0.0 108.729 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.423 ' O ' ' NZ ' ' A' ' 23' ' ' LYS . . . -153.41 -129.28 1.36 Allowed Glycine 0 N--CA 1.486 2.027 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.5 p -141.39 155.37 45.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.11 -1.23 . . . . 0.0 110.482 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.451 ' O ' ' C ' ' A' ' 28' ' ' ASN . 97.4 m -123.16 -167.79 1.66 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.397 -0.814 . . . . 0.0 109.757 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.451 ' C ' ' O ' ' A' ' 27' ' ' CYS . 19.5 m120 -39.57 147.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.607 -0.683 . . . . 0.0 110.169 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.408 ' C ' ' O ' ' A' ' 28' ' ' ASN . 78.7 t80 -42.39 -41.17 2.78 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -0.938 . . . . 0.0 110.792 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -85.24 4.35 35.15 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.114 -0.991 . . . . 0.0 110.853 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.609 ' CE2' ' CG ' ' A' ' 15' ' ' GLN . 96.0 m-85 -139.96 157.03 46.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.071 -1.018 . . . . 0.0 110.66 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.505 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 57.5 mttp -127.39 157.64 39.45 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.426 -0.797 . . . . 0.0 109.825 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 44.5 t -80.93 127.13 32.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.273 -0.892 . . . . 0.0 110.924 -179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.7 m -141.6 140.32 33.32 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.503 -0.748 . . . . 0.0 109.916 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -136.21 152.7 51.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.15 -0.969 . . . . 0.0 110.329 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.562 ' CE1' ' CZ ' ' A' ' 21' ' ' PHE . 67.5 m-85 -61.73 167.38 3.64 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.303 -0.873 . . . . 0.0 110.015 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.142 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.245 0.545 . . . . 0.0 110.462 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.6 m -61.57 -22.25 65.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.774 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -66.71 -44.02 82.76 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.388 -0.82 . . . . 0.0 109.975 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -59.75 -40.63 88.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.409 -0.807 . . . . 0.0 109.97 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -67.95 -27.62 66.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.338 -0.851 . . . . 0.0 110.152 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.04 11.07 59.15 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.18 -177.68 9.8 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -125.07 145.69 49.8 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.287 -1.125 . . . . 0.0 110.275 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.539 ' O ' HD23 ' A' ' 14' ' ' LEU . 84.8 m -124.46 131.0 53.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.361 -0.837 . . . . 0.0 110.141 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.539 HD23 ' O ' ' A' ' 13' ' ' CYS . 25.3 mt -120.02 146.08 46.21 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -55.66 -28.05 53.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.162 -0.961 . . . . 0.0 108.671 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.46 ' O ' HG13 ' A' ' 18' ' ' ILE . 99.1 mtt180 -135.71 63.58 1.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.45 ' C ' HG13 ' A' ' 18' ' ' ILE . 42.3 t -49.56 116.74 1.88 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.53 -0.731 . . . . 0.0 111.06 -179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.593 HG22 ' N ' ' A' ' 19' ' ' GLY . 61.5 mt -151.26 172.68 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.414 -0.804 . . . . 0.0 109.499 179.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.593 ' N ' HG22 ' A' ' 18' ' ' ILE . . . 92.53 -162.02 26.53 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.4 mt -53.5 -19.96 4.31 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.388 -1.066 . . . . 0.0 110.474 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -75.57 145.45 41.21 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.282 -0.886 . . . . 0.0 110.365 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.435 ' CD2' HG12 ' A' ' 24' ' ' ILE . 35.2 p-80 -121.58 176.79 5.51 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.447 ' HE3' ' HD2' ' A' ' 32' ' ' LYS . 86.4 tttt -103.7 110.86 23.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.449 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 35' ' ' LYS . 7.1 mt -88.23 -34.85 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.85 . . . . 0.0 109.069 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.11 -163.25 21.73 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 m -94.15 165.69 12.49 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.026 -1.279 . . . . 0.0 110.614 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 31' ' ' PHE . 1.1 t -122.78 -158.55 0.79 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.379 -0.826 . . . . 0.0 110.183 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -71.95 151.75 43.04 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.649 -0.657 . . . . 0.0 110.565 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 8.9 t80 48.3 -124.88 1.83 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.473 -0.767 . . . . 0.0 110.778 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -104.92 14.52 29.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.882 -1.136 . . . . 0.0 111.197 -179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.429 ' O ' ' HB3' ' A' ' 27' ' ' CYS . 60.1 m-85 -84.07 142.55 30.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.012 -1.055 . . . . 0.0 110.189 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HD2' ' HE3' ' A' ' 23' ' ' LYS . 75.2 mmtt -90.07 159.16 16.96 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.28 -0.888 . . . . 0.0 110.65 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.46 ' HA ' ' SG ' ' A' ' 13' ' ' CYS . 16.8 t -89.6 131.81 35.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.309 -0.869 . . . . 0.0 109.985 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.406 ' SG ' ' O ' ' A' ' 22' ' ' HIS . 67.3 m -149.54 137.01 20.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.155 -0.966 . . . . 0.0 110.518 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.556 ' HB2' HD11 ' A' ' 24' ' ' ILE . 58.7 mtpt -125.96 157.8 36.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.451 -0.78 . . . . 0.0 110.024 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -95.51 132.43 40.62 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.245 -0.909 . . . . 0.0 110.29 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.216 179.932 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.276 0.56 . . . . 0.0 110.437 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 80.5 m -58.52 -23.09 57.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -68.75 -44.04 74.57 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.343 -0.848 . . . . 0.0 110.267 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -65.12 -41.84 94.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -0.928 . . . . 0.0 110.143 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.65 -29.48 68.07 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.158 -0.964 . . . . 0.0 110.093 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.85 3.74 68.0 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -74.47 -169.55 22.21 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 34' ' ' CYS . 87.9 mt-10 -133.2 149.08 52.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -1.091 . . . . 0.0 109.788 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.808 ' C ' HD22 ' A' ' 14' ' ' LEU . 72.9 m -109.9 129.95 55.59 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.05 -1.031 . . . . 0.0 110.446 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.815 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -118.98 145.65 45.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.355 -0.841 . . . . 0.0 110.191 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -63.13 -29.14 70.56 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.061 -1.024 . . . . 0.0 109.074 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.478 ' O ' ' C ' ' A' ' 17' ' ' CYS . 87.4 mtm180 -138.79 59.49 1.62 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.591 -0.693 . . . . 0.0 109.678 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.478 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.2 t -33.87 132.34 0.24 Allowed 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.5 0.667 . . . . 0.0 111.061 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.565 HG22 ' N ' ' A' ' 19' ' ' GLY . 75.5 mt -91.25 173.65 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.437 -0.789 . . . . 0.0 110.31 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.565 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -59.62 -50.89 62.85 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.695 ' C ' HD13 ' A' ' 20' ' ' LEU . 3.3 tm? -44.11 -45.53 8.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.4 -1.059 . . . . 0.0 110.045 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -80.04 135.7 36.41 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.421 -0.799 . . . . 0.0 109.995 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.438 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.5 m-70 -99.43 137.42 37.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.127 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.521 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 85.5 tttt -88.75 119.25 29.06 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.317 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.749 HD11 ' SG ' ' A' ' 33' ' ' CYS . 37.4 pt -86.16 -30.35 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.257 -0.902 . . . . 0.0 110.124 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.53 ' N ' HG13 ' A' ' 24' ' ' ILE . . . -168.23 -135.64 1.91 Allowed Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -121.22 140.43 52.04 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.239 -1.154 . . . . 0.0 110.523 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.472 ' HB2' ' C ' ' A' ' 32' ' ' LYS . 1.6 t -110.79 -161.6 0.76 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 27' ' ' CYS . 83.5 m-20 -46.23 141.99 3.12 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 119.693 -0.803 . . . . 0.0 109.447 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.98 -21.36 0.13 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.075 -1.015 . . . . 0.0 110.797 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.487 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 16.2 tpt180 -93.24 -3.64 53.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.003 -1.061 . . . . 0.0 110.424 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -148.11 157.01 43.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.854 -1.154 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.509 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 73.3 mmtt -101.88 158.34 16.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.365 -0.834 . . . . 0.0 109.69 179.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.749 ' SG ' HD11 ' A' ' 24' ' ' ILE . 7.0 t -85.85 115.07 23.27 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.143 -0.973 . . . . 0.0 110.421 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.491 ' O ' ' N ' ' A' ' 12' ' ' GLU . 85.0 m -131.96 142.57 49.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.356 -0.84 . . . . 0.0 110.07 179.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -123.72 129.1 50.57 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.989 . . . . 0.0 110.371 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -80.71 139.93 35.86 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.917 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.113 179.906 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.208 0.527 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.5 t -59.54 -23.08 62.56 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.222 -0.924 . . . . 0.0 109.943 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -70.37 -40.18 74.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.257 -0.902 . . . . 0.0 110.004 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -66.63 -33.45 75.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.306 -0.871 . . . . 0.0 109.875 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -65.34 -34.54 78.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 19.78 78.09 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.61 -152.3 7.16 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -121.06 146.85 46.28 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -1.192 . . . . 0.0 109.836 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.861 ' C ' HD22 ' A' ' 14' ' ' LEU . 74.2 m -121.73 116.4 24.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.967 . . . . 0.0 110.367 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.861 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.9 mm? -120.93 147.32 45.6 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.321 -0.862 . . . . 0.0 109.764 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.438 ' OE1' ' HA ' ' A' ' 31' ' ' PHE . 16.2 mm-40 -54.78 -21.42 11.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.98 -1.075 . . . . 0.0 109.347 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -169.34 71.76 0.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.583 -0.698 . . . . 0.0 109.701 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 28.7 p -63.99 145.29 56.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.0 110.741 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 32.5 pt -141.1 159.23 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.641 -0.662 . . . . 0.0 110.153 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.57 -145.81 17.33 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.498 ' O ' ' CD2' ' A' ' 22' ' ' HIS . 26.3 mt -61.85 -16.18 48.2 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.399 -1.06 . . . . 0.0 110.228 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -72.59 135.34 45.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.339 -0.85 . . . . 0.0 111.028 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.515 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 94.6 m-70 -121.53 151.76 39.95 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.412 -0.805 . . . . 0.0 109.016 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.509 ' HE2' HG22 ' A' ' 26' ' ' THR . 60.2 tttm -93.54 126.64 38.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.868 -1.145 . . . . 0.0 111.66 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mt -101.49 -37.17 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.46 -148.59 5.17 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 43.5 p -136.31 149.0 48.23 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.072 -1.252 . . . . 0.0 110.469 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 8.1 m -115.69 163.91 15.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.355 -0.841 . . . . 0.0 109.732 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.52 ' O ' ' N ' ' A' ' 30' ' ' ARG . 54.8 t-20 38.98 29.72 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.432 -0.792 . . . . 0.0 110.692 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.486 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 85.1 t80 60.34 -74.75 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.437 -0.789 . . . . 0.0 110.509 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 28' ' ' ASN . 81.6 mtt180 -58.39 -49.35 77.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.2 -0.938 . . . . 0.0 110.513 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.438 ' HA ' ' OE1' ' A' ' 15' ' ' GLN . 90.5 m-85 -71.05 158.47 36.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.19 -0.943 . . . . 0.0 110.516 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 71.3 mmtt -108.58 168.35 9.4 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.0 t -107.0 133.87 51.0 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.185 -0.947 . . . . 0.0 109.787 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 96.1 m -140.52 134.69 30.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.453 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -110.79 148.65 31.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.354 -0.841 . . . . 0.0 110.401 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -81.87 145.21 30.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.223 -0.923 . . . . 0.0 109.925 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.489 ' OE1' ' CD2' ' A' ' 22' ' ' HIS . 61.6 tt0 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.263 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.668 ' HB3' ' HD2' ' A' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.384 0.611 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.9 t -52.75 -27.2 16.78 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -69.69 -33.68 72.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.363 -0.836 . . . . 0.0 110.129 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.668 ' HD2' ' HB3' ' A' ' 5' ' ' ALA . 79.8 mtt85 -73.95 -29.74 62.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.2 -0.938 . . . . 0.0 109.924 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.29 -24.42 63.95 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.72 4.52 36.71 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.425 ' CA ' ' HG2' ' A' ' 35' ' ' LYS . . . -86.78 -173.9 49.05 Favored Glycine 0 N--CA 1.49 2.233 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -124.96 142.8 51.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.21 -1.171 . . . . 0.0 110.224 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.789 ' C ' HD22 ' A' ' 14' ' ' LEU . 48.0 m -92.99 133.14 36.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.272 -0.892 . . . . 0.0 110.185 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.789 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.9 mm? -130.8 142.45 50.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.222 -0.924 . . . . 0.0 110.142 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.455 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 89.0 mt-30 -74.27 -21.68 59.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.294 -0.879 . . . . 0.0 110.569 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.424 ' O ' ' C ' ' A' ' 17' ' ' CYS . 92.1 mtt180 -148.83 62.01 1.06 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.108 -0.995 . . . . 0.0 110.639 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.492 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 92.5 m -41.86 144.18 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.159 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.41 HG22 ' HD1' ' A' ' 21' ' ' PHE . 16.8 tt -119.5 176.73 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.168 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.08 -45.21 26.68 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.403 ' HB2' HG23 ' A' ' 18' ' ' ILE . 99.5 mt -52.68 -29.47 26.75 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.608 -0.936 . . . . 0.0 110.652 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.485 ' CE2' ' HB2' ' A' ' 36' ' ' PHE . 87.9 m-85 -113.38 146.06 40.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.126 -0.984 . . . . 0.0 110.542 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.448 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.1 m-70 -106.87 134.12 50.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.736 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 39.0 ttpt -92.92 97.65 10.87 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.117 -0.989 . . . . 0.0 110.617 -179.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.601 HG23 ' N ' ' A' ' 25' ' ' GLY . 18.9 tt -64.41 -43.39 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.161 -0.962 . . . . 0.0 109.832 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.601 ' N ' HG23 ' A' ' 24' ' ' ILE . . . -155.17 -148.11 4.91 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.4 p -120.99 150.11 41.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.251 -1.147 . . . . 0.0 110.133 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 32' ' ' LYS . 92.4 m -77.68 -169.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 110.423 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.439 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 81.0 m-20 -51.71 -39.75 58.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.215 -0.928 . . . . 0.0 110.481 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.552 ' CD2' ' HB2' ' A' ' 30' ' ' ARG . 60.0 t80 -179.32 150.59 0.44 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.49 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.552 ' HB2' ' CD2' ' A' ' 29' ' ' PHE . 68.2 ttt180 66.16 -59.15 0.33 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.437 -0.789 . . . . 0.0 111.127 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.475 ' N ' ' O ' ' A' ' 29' ' ' PHE . 96.6 m-85 -79.48 157.12 27.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 0.0 110.647 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.497 ' HD2' ' CD ' ' A' ' 23' ' ' LYS . 50.3 mtmt -110.14 158.33 18.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.484 -0.76 . . . . 0.0 109.989 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.529 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 37.7 t -86.89 118.21 26.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.185 -0.947 . . . . 0.0 110.464 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 55.6 m -138.71 132.4 30.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.367 -0.833 . . . . 0.0 110.024 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HG2' ' CA ' ' A' ' 11' ' ' GLY . 98.6 mttt -113.37 139.81 48.57 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.295 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HB2' ' CE2' ' A' ' 21' ' ' PHE . 91.2 t80 -108.13 142.89 37.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.324 -0.86 . . . . 0.0 110.149 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.192 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.275 0.559 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.536 ' CA ' ' HA3' ' A' ' 10' ' ' GLY . 59.5 m -71.9 -15.86 62.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -73.26 -29.64 62.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.293 -0.879 . . . . 0.0 110.444 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -83.89 -45.42 13.23 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.396 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -135.23 0.78 2.86 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.208 -0.932 . . . . 0.0 110.617 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.536 ' HA3' ' CA ' ' A' ' 6' ' ' CYS . . . -56.9 -23.2 44.63 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 72.15 -99.25 0.86 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -136.78 159.11 42.83 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -1.177 . . . . 0.0 110.303 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.49 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 57.7 m -120.24 150.04 41.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.21 -0.931 . . . . 0.0 110.655 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.719 HD12 ' H ' ' A' ' 15' ' ' GLN . 4.7 tp -148.45 160.28 43.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.351 -0.843 . . . . 0.0 109.872 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.719 ' H ' HD12 ' A' ' 14' ' ' LEU . 46.6 tt0 -69.22 -52.16 30.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.544 -0.723 . . . . 0.0 110.064 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -106.61 80.64 1.49 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.329 -0.857 . . . . 0.0 110.022 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.616 ' O ' HD13 ' A' ' 18' ' ' ILE . 7.2 t -77.11 81.07 3.63 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.616 HD13 ' O ' ' A' ' 17' ' ' CYS . 18.7 mm -136.85 166.84 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 110.487 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.414 ' N ' HG22 ' A' ' 18' ' ' ILE . . . 86.66 -128.06 8.7 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.406 ' HA ' HD12 ' A' ' 20' ' ' LEU . 23.7 tp -67.97 -32.17 72.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -1.141 . . . . 0.0 110.813 -179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 36' ' ' PHE . 90.7 m-85 -80.44 132.65 35.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.204 -0.935 . . . . 0.0 110.415 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -107.11 141.67 37.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.299 -0.875 . . . . 0.0 109.889 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.468 ' CD ' ' HD3' ' A' ' 32' ' ' LYS . 21.0 ttpt -89.42 114.01 25.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.142 -0.974 . . . . 0.0 110.473 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.411 HG13 ' HG3' ' A' ' 35' ' ' LYS . 22.7 mm -77.74 -41.89 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.309 -0.869 . . . . 0.0 108.761 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -164.12 -129.28 1.02 Allowed Glycine 0 N--CA 1.486 2.023 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 38.8 p -127.13 150.4 49.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.167 -1.196 . . . . 0.0 109.855 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.476 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -84.67 -160.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -0.997 . . . . 0.0 111.021 -179.62 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -62.48 -42.98 99.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.86 -0.525 . . . . 0.0 110.963 -179.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.565 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 81.7 t80 -177.08 143.98 0.42 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.17 -0.956 . . . . 0.0 110.543 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.538 ' O ' ' CD1' ' A' ' 31' ' ' PHE . 12.0 tpp180 52.33 19.63 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.284 -0.885 . . . . 0.0 110.255 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.565 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 47.9 m-85 -149.62 154.63 38.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 0.0 110.044 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.468 ' HD3' ' CD ' ' A' ' 23' ' ' LYS . 62.8 mttp -112.5 158.1 20.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.233 -0.917 . . . . 0.0 110.455 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.0 t -85.21 124.5 31.93 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.315 -0.866 . . . . 0.0 109.838 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 65.3 m -135.54 141.59 45.25 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.181 -0.95 . . . . 0.0 110.531 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.411 ' HG3' HG13 ' A' ' 24' ' ' ILE . 58.2 mtpt -116.59 127.31 54.37 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.31 -0.869 . . . . 0.0 109.909 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.401 ' CD1' ' CE1' ' A' ' 21' ' ' PHE . 92.2 t80 -98.41 139.72 33.74 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.173 -0.954 . . . . 0.0 110.562 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.085 179.747 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.873 ' HB1' ' CE2' ' A' ' 7' ' ' TYR . . . . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.342 0.591 . . . . 0.0 109.767 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -74.73 -21.2 59.49 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.432 -0.792 . . . . 0.0 110.02 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.873 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 53.2 p90 -69.31 -44.73 71.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.413 -0.804 . . . . 0.0 109.647 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.63 ' N ' ' CD1' ' A' ' 7' ' ' TYR . 38.9 ttm180 -57.68 -42.66 84.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.37 -0.831 . . . . 0.0 109.906 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.442 ' OE1' HD13 ' A' ' 24' ' ' ILE . 41.6 mt-10 -67.02 -29.68 69.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.068 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.16 9.56 61.94 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.15 176.68 26.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -132.21 146.47 52.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.246 -1.15 . . . . 0.0 110.326 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.495 ' O ' HD23 ' A' ' 14' ' ' LEU . 79.1 m -103.57 130.76 51.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.255 -0.903 . . . . 0.0 109.95 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 13' ' ' CYS . 15.0 mt -112.32 141.58 45.87 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.148 -0.97 . . . . 0.0 110.499 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -56.64 -24.74 50.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 0.0 109.665 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.415 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.9 mtt-85 -137.91 55.12 1.78 Allowed 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.6 t -39.81 130.71 1.94 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.528 -0.733 . . . . 0.0 110.725 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.484 HG22 ' N ' ' A' ' 19' ' ' GLY . 40.7 mm -100.23 171.03 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.473 -0.767 . . . . 0.0 110.203 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.484 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -59.09 -46.41 93.8 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.403 ' C ' ' O ' ' A' ' 19' ' ' GLY . 34.0 tp -42.1 -37.92 1.54 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.607 -0.937 . . . . 0.0 110.179 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.457 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 88.4 m-85 -89.22 113.55 24.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.357 -0.839 . . . . 0.0 110.433 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.483 ' O ' ' N ' ' A' ' 35' ' ' LYS . 85.3 t60 -62.53 138.84 58.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.284 -0.885 . . . . 0.0 109.834 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -99.54 112.13 24.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 110.451 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.442 HD13 ' OE1' ' A' ' 9' ' ' GLU . 15.1 mt -72.63 -39.61 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.289 -0.882 . . . . 0.0 108.658 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.412 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -174.56 -129.7 1.21 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.8 p -120.22 155.8 32.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.209 -1.171 . . . . 0.0 110.028 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' PHE . 0.6 OUTLIER -94.59 -159.38 0.7 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -0.999 . . . . 0.0 110.438 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 43.9 t30 -43.09 -53.12 5.08 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.699 -0.625 . . . . 0.0 110.222 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.448 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 58.7 t80 -178.66 -61.84 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.49 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -68.8 -34.63 75.85 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.27 -0.894 . . . . 0.0 110.98 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.495 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 91.2 m-85 -103.51 156.11 18.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.018 -1.051 . . . . 0.0 110.591 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -102.7 159.25 15.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.389 -0.819 . . . . 0.0 109.936 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.412 ' HB3' ' H ' ' A' ' 25' ' ' GLY . 34.2 t -82.88 127.97 33.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.24 -0.913 . . . . 0.0 110.122 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 57.5 m -134.01 152.86 52.02 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.148 -0.97 . . . . 0.0 110.404 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.483 ' N ' ' O ' ' A' ' 22' ' ' HIS . 52.9 tttp -127.62 119.77 26.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.357 -0.839 . . . . 0.0 110.156 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -77.22 141.38 40.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.245 -0.91 . . . . 0.0 110.264 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.441 ' CG ' ' OXT' ' A' ' 37' ' ' GLN . 3.6 tt0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 117.934 -1.032 . . . . 0.0 110.167 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.205 0.526 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.6 p -62.71 -38.21 89.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.257 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -123.76 153.78 40.45 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 0.0 110.177 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -126.29 162.48 25.38 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.234 -0.916 . . . . 0.0 110.231 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.35 111.96 13.58 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -0.891 . . . . 0.0 110.193 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.95 -24.42 67.72 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.293 -0.879 . . . . 0.0 109.93 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -66.55 -43.86 83.94 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.888 . . . . 0.0 110.018 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -63.31 -35.22 79.65 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.295 -0.878 . . . . 0.0 109.981 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -66.19 -31.02 71.6 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 110.148 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.61 32.75 29.65 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.14 -172.01 48.5 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -117.76 147.69 42.75 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.268 -1.136 . . . . 0.0 110.294 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.714 ' C ' HD22 ' A' ' 14' ' ' LEU . 16.1 m -99.08 120.24 39.15 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.747 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -116.11 138.19 51.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.126 -0.984 . . . . 0.0 110.402 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.53 ' HG2' ' CE1' ' A' ' 31' ' ' PHE . 74.1 mt-30 -65.52 -27.51 68.52 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.347 -0.846 . . . . 0.0 109.915 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.7 mtm180 -141.33 58.49 1.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.413 -0.805 . . . . 0.0 110.101 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.442 ' C ' ' O ' ' A' ' 16' ' ' ARG . 19.1 t -38.58 124.57 1.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.482 -0.761 . . . . 0.0 110.823 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.581 HG22 ' N ' ' A' ' 19' ' ' GLY . 72.0 mt -91.59 173.93 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.051 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.581 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -56.88 -48.7 76.59 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.753 HD13 ' O ' ' A' ' 20' ' ' LEU . 3.1 tm? -40.81 -40.8 1.43 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.541 -0.976 . . . . 0.0 110.439 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 93.4 m-85 -88.39 118.71 28.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.43 -0.794 . . . . 0.0 110.497 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.487 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 97.2 m-70 -67.59 150.07 49.26 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.132 -0.98 . . . . 0.0 109.507 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -105.28 125.55 51.11 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.041 -1.037 . . . . 0.0 111.026 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.0 mm -100.76 -37.53 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 CA-C-O 121.737 0.78 . . . . 0.0 109.021 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -171.83 -150.42 7.17 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.325 -1.51 . . . . 0.0 109.325 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.2 p -119.15 160.2 22.55 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -1.219 . . . . 0.0 110.345 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 86.4 m -87.1 -164.92 1.16 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.219 -0.925 . . . . 0.0 110.627 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -64.92 -42.18 94.91 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.552 -0.718 . . . . 0.0 110.861 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.64 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 66.8 t80 -175.09 140.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -0.924 . . . . 0.0 110.473 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.64 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 38.4 mmt180 57.47 20.68 6.26 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.392 -0.818 . . . . 0.0 110.449 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.53 ' CE1' ' HG2' ' A' ' 15' ' ' GLN . 43.7 m-85 -148.12 152.43 37.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.187 -0.946 . . . . 0.0 110.113 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 27' ' ' CYS . 92.9 mttt -117.81 158.07 25.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.174 -0.954 . . . . 0.0 109.921 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.3 t -94.81 119.34 33.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 87.0 m -136.37 165.12 26.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.387 -0.821 . . . . 0.0 110.063 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -127.83 141.66 51.51 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -106.59 139.14 41.51 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.312 -0.867 . . . . 0.0 110.058 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.273 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . 0.4 ' O ' ' HG3' ' A' ' 3' ' ' LYS . 27.1 m120 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.331 0.586 . . . . 0.0 110.141 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.1 m 52.21 47.38 24.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.175 -0.953 . . . . 0.0 110.26 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 1' ' ' ASN . 86.3 mttt -118.81 138.84 52.42 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.264 -0.898 . . . . 0.0 109.982 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 45.0 mtm-85 -128.07 167.77 16.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.182 -0.949 . . . . 0.0 110.256 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.55 ' HB3' ' HE ' ' A' ' 8' ' ' ARG . . . -92.3 108.44 19.96 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.325 -0.859 . . . . 0.0 110.45 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.5 t -59.39 -25.78 64.57 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.182 -0.948 . . . . 0.0 109.899 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -63.58 -41.89 98.33 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.295 -0.878 . . . . 0.0 110.114 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.55 ' HE ' ' HB3' ' A' ' 5' ' ' ALA . 53.6 mtm180 -75.17 -33.27 61.45 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.318 -0.864 . . . . 0.0 110.261 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -65.77 -25.78 67.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.317 -0.864 . . . . 0.0 110.116 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.96 12.83 73.3 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.2 165.21 13.01 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.423 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 68.4 mm-40 -100.92 141.61 33.56 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.302 -1.117 . . . . 0.0 110.255 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.7 m -100.19 129.87 46.26 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.168 -0.957 . . . . 0.0 110.436 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 14' ' ' LEU . 13.2 tp -124.44 166.67 15.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.085 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -79.23 -30.91 43.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.177 -0.952 . . . . 0.0 109.777 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 17' ' ' CYS . 34.0 ttm180 -146.66 76.33 1.43 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.503 -0.748 . . . . 0.0 109.312 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.437 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.8 t -36.08 126.07 0.75 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.431 0.634 . . . . 0.0 111.057 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.1 pt -95.95 178.82 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.338 -0.851 . . . . 0.0 110.253 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' A' ' 20' ' ' LEU . . . -56.9 -175.57 0.29 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 19' ' ' GLY . 60.0 mt 61.13 11.42 3.46 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.353 -1.087 . . . . 0.0 110.332 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -135.78 131.0 34.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.067 -1.021 . . . . 0.0 110.505 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -99.34 142.09 31.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.421 -0.8 . . . . 0.0 109.481 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 84.7 tttt -95.72 112.04 23.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.055 -1.028 . . . . 0.0 111.166 -179.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.407 HD13 HG21 ' A' ' 24' ' ' ILE . 5.6 mt -87.99 -34.23 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.305 -0.872 . . . . 0.0 108.737 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.76 -156.68 8.33 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.5 p -123.61 156.33 36.0 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.198 -1.178 . . . . 0.0 110.463 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.473 ' HB2' ' HB2' ' A' ' 31' ' ' PHE . 83.6 m -74.94 -166.7 0.5 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.375 -0.828 . . . . 0.0 110.427 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 47.4 t30 -71.64 -35.7 70.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.605 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.574 ' CE2' ' HG3' ' A' ' 30' ' ' ARG . 54.2 t80 179.64 144.96 0.18 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.372 -0.83 . . . . 0.0 110.141 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.574 ' HG3' ' CE2' ' A' ' 29' ' ' PHE . 95.3 mtt180 57.18 19.01 4.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.408 -0.807 . . . . 0.0 110.972 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.473 ' HB2' ' HB2' ' A' ' 27' ' ' CYS . 44.1 m-85 -150.48 158.93 44.71 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.899 -1.125 . . . . 0.0 110.655 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.421 ' C ' ' SG ' ' A' ' 27' ' ' CYS . 35.6 mmtp -126.45 159.11 34.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.324 -0.86 . . . . 0.0 109.938 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 36.4 t -88.22 125.98 34.91 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.194 -0.941 . . . . 0.0 110.166 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 70.1 m -120.28 137.11 54.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 109.928 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -121.41 131.51 54.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.117 -0.99 . . . . 0.0 110.374 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 37' ' ' GLN . 62.2 t80 -103.45 128.17 50.67 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.473 ' HB3' ' O ' ' A' ' 36' ' ' PHE . 52.5 tt0 . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 72.9 m-80 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.193 0.52 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.2 p -60.43 -23.49 64.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.265 -0.897 . . . . 0.0 110.18 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -132.23 146.5 52.05 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.266 -0.896 . . . . 0.0 110.293 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -126.57 157.18 39.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.234 -0.916 . . . . 0.0 110.372 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.25 115.2 21.85 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.296 -0.878 . . . . 0.0 110.237 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.1 t -63.19 -21.02 65.94 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.231 -0.918 . . . . 0.0 110.062 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -70.48 -37.38 74.24 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.924 . . . . 0.0 109.747 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttp85 -63.75 -37.18 86.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.482 -0.761 . . . . 0.0 109.946 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.508 ' CD ' HD12 ' A' ' 24' ' ' ILE . 52.1 mt-10 -69.06 -33.6 73.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.082 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.25 14.87 79.72 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.92 161.83 49.1 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.361 -1.496 . . . . 0.0 109.361 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.525 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 76.3 tt0 -101.97 139.95 36.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.157 -1.202 . . . . 0.0 110.392 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.88 ' C ' HD22 ' A' ' 14' ' ' LEU . 67.6 m -84.71 130.87 34.64 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.36 -0.838 . . . . 0.0 110.13 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.88 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.0 mm? -124.54 135.32 53.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 110.3 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.99 -30.65 71.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.239 -0.913 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 17' ' ' CYS . 70.2 mtm180 -139.92 58.97 1.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.372 -0.83 . . . . 0.0 109.761 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.439 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.1 t -40.03 137.91 0.9 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.448 -0.783 . . . . 0.0 110.616 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 46.6 pt -114.14 179.53 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.363 -0.836 . . . . 0.0 110.499 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -54.5 -48.9 62.93 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 20' ' ' LEU . 15.5 tp -40.69 -41.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.649 -0.912 . . . . 0.0 110.45 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.488 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 90.1 m-85 -98.31 137.07 37.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.437 -0.789 . . . . 0.0 110.155 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -97.88 126.05 43.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.191 -0.943 . . . . 0.0 109.974 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.95 127.3 32.11 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.229 -0.919 . . . . 0.0 110.756 -179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.6 HG21 ' HB2' ' A' ' 35' ' ' LYS . 46.3 pt -103.44 -13.28 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.345 -0.847 . . . . 0.0 109.745 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.84 -136.78 3.74 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 3.1 m -138.16 157.61 45.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.097 -1.237 . . . . 0.0 110.227 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.448 ' O ' ' C ' ' A' ' 28' ' ' ASN . 72.8 m -93.7 -161.08 0.81 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.408 -0.808 . . . . 0.0 109.857 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.493 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.9 t30 -41.11 -46.56 3.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.521 -0.737 . . . . 0.0 110.149 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.493 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 92.3 t80 178.95 -63.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.397 -0.814 . . . . 0.0 110.816 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -61.99 -40.81 96.91 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.339 -0.85 . . . . 0.0 111.38 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.446 ' HB3' ' HB3' ' A' ' 13' ' ' CYS . 97.4 m-85 -96.01 164.27 12.78 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.067 -1.021 . . . . 0.0 111.492 -178.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.455 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 59.3 mttp -116.4 160.53 20.42 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.657 -0.652 . . . . 0.0 109.318 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 26' ' ' THR . 67.4 m -92.35 121.45 33.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.946 -1.096 . . . . 0.0 110.673 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.54 ' HB2' HD23 ' A' ' 14' ' ' LEU . 68.8 m -127.85 136.81 51.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.442 -0.786 . . . . 0.0 109.865 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.6 ' HB2' HG21 ' A' ' 24' ' ' ILE . 81.6 tttt -115.49 133.74 55.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.427 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -99.97 141.97 32.08 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.153 179.818 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 55.5 t30 . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.318 0.58 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -74.46 -35.72 63.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.208 -0.933 . . . . 0.0 110.207 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -57.62 -41.55 81.53 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.294 -0.879 . . . . 0.0 110.329 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -115.2 152.98 31.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.454 -0.779 . . . . 0.0 110.273 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -99.87 111.5 23.81 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.344 -0.848 . . . . 0.0 110.556 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.2 t -60.02 -23.26 63.56 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.959 . . . . 0.0 109.841 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -65.18 -37.7 88.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.919 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -62.53 -37.65 86.92 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.3 -0.875 . . . . 0.0 109.917 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.48 17.96 72.24 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -177.6 43.25 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -105.86 135.05 48.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.28 -1.13 . . . . 0.0 110.102 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.903 ' C ' HD22 ' A' ' 14' ' ' LEU . 87.9 m -92.91 130.52 38.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 110.239 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.903 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.2 mm? -132.09 143.64 50.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.386 -0.821 . . . . 0.0 110.119 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.539 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 11.2 pt20 -63.2 -33.22 75.0 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.213 -0.929 . . . . 0.0 109.428 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' A' ' 15' ' ' GLN . 78.8 mtt85 -158.4 61.97 0.44 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.601 -0.687 . . . . 0.0 109.714 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.598 ' O ' HG23 ' A' ' 18' ' ' ILE . 22.2 p -60.52 146.88 43.35 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.19 -0.944 . . . . 0.0 110.494 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.598 HG23 ' O ' ' A' ' 17' ' ' CYS . 29.5 pt -158.82 158.25 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.433 -0.792 . . . . 0.0 110.454 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.57 -119.75 4.98 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.6 mt -61.94 -23.16 66.19 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.31 -1.112 . . . . 0.0 110.554 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.438 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 80.0 m-85 -103.73 129.16 51.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.133 -0.98 . . . . 0.0 111.042 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.523 ' HB3' ' NE2' ' A' ' 37' ' ' GLN . 82.7 t60 -119.27 139.44 51.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.387 -0.82 . . . . 0.0 109.174 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -74.27 123.04 23.82 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.028 -1.045 . . . . 0.0 111.132 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.516 HG13 ' CG ' ' A' ' 35' ' ' LYS . 14.6 mm -93.38 -37.47 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -156.42 -143.49 3.68 Favored Glycine 0 N--CA 1.487 2.059 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 27.6 p -127.78 164.49 22.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.127 -1.219 . . . . 0.0 110.466 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 81.7 m -123.31 -176.96 3.56 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.243 -0.91 . . . . 0.0 110.125 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.512 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 51.6 t-20 -60.03 146.17 43.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 110.157 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.5 t80 70.98 -150.97 0.09 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.305 -0.872 . . . . 0.0 110.417 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -87.71 -5.4 58.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.255 -0.903 . . . . 0.0 110.732 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -72.09 138.9 48.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.183 -0.948 . . . . 0.0 110.234 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 94.2 mttt -103.18 164.93 11.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.214 -0.929 . . . . 0.0 110.301 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 13' ' ' CYS . 23.8 m -93.97 134.83 35.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 110.369 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.459 ' HB2' HD23 ' A' ' 14' ' ' LEU . 78.2 m -138.97 134.68 33.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.255 -0.903 . . . . 0.0 109.98 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.516 ' CG ' HG13 ' A' ' 24' ' ' ILE . 98.7 mttt -113.94 143.32 44.91 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.136 -0.978 . . . . 0.0 110.294 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 138.45 51.68 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 110.15 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.523 ' NE2' ' HB3' ' A' ' 22' ' ' HIS . 68.3 mt-30 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.251 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.176 0.512 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.4 t -59.39 -43.57 92.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 110.053 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -99.09 139.85 34.13 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.186 -0.946 . . . . 0.0 110.264 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.409 ' NH1' HG22 ' A' ' 24' ' ' ILE . 54.2 ttp180 -79.28 153.28 30.0 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.248 -0.907 . . . . 0.0 109.795 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.05 98.82 5.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.241 -0.912 . . . . 0.0 110.451 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.9 m -54.55 -34.76 62.38 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.389 -0.82 . . . . 0.0 109.646 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -61.08 -42.63 98.86 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.519 -0.738 . . . . 0.0 109.847 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.7 ttt-85 -63.69 -35.49 80.71 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.44 -0.788 . . . . 0.0 110.235 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -71.39 -21.21 62.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 110.252 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.24 19.34 33.43 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -165.37 40.33 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.349 -1.5 . . . . 0.0 109.349 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 39.5 tp10 -135.88 148.49 48.64 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.242 -1.151 . . . . 0.0 110.178 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.774 ' C ' HD22 ' A' ' 14' ' ' LEU . 67.1 m -111.27 121.04 44.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.229 -0.919 . . . . 0.0 110.374 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.784 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -119.8 150.57 40.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.232 -0.918 . . . . 0.0 110.091 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -62.38 -35.2 78.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.114 -0.991 . . . . 0.0 109.699 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.772 ' O ' HG23 ' A' ' 18' ' ' ILE . 57.6 mtp180 -141.96 58.76 1.48 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.422 -0.799 . . . . 0.0 109.723 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 2.0 t -50.73 121.59 6.09 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.333 -0.855 . . . . 0.0 110.57 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.772 HG23 ' O ' ' A' ' 16' ' ' ARG . 25.9 pt -140.9 164.92 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.46 -0.775 . . . . 0.0 110.036 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.05 -151.71 17.61 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.5 mt -59.48 -17.99 36.16 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -1.167 . . . . 0.0 110.02 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -68.91 140.49 55.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.402 -0.811 . . . . 0.0 110.91 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 89.2 m-70 -114.63 162.51 16.68 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.316 -0.865 . . . . 0.0 109.413 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -91.48 111.96 23.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.929 -1.107 . . . . 0.0 110.848 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.409 HG22 ' NH1' ' A' ' 4' ' ' ARG . 10.4 mm -87.86 -35.19 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.06 -148.79 5.83 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 25.0 p -129.53 152.19 49.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.311 -1.111 . . . . 0.0 110.007 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.566 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 80.1 m -106.14 -174.75 2.61 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.109 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.522 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 93.3 m-20 -99.37 160.88 13.96 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.292 -0.88 . . . . 0.0 110.428 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.601 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 1.5 t80 71.16 39.03 1.0 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.28 -0.887 . . . . 0.0 110.271 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 95.5 mtt180 62.52 62.36 1.13 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 110.415 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.601 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 42.3 m-85 -145.68 155.06 42.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.218 -0.926 . . . . 0.0 110.055 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 48.2 mtmt -113.95 166.95 11.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.15 -0.969 . . . . 0.0 110.338 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.8 t -108.94 128.23 54.75 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 19.5 p -153.08 145.32 23.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.277 -0.889 . . . . 0.0 110.019 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -124.32 156.34 37.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.483 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -79.84 139.88 37.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.356 -0.84 . . . . 0.0 110.02 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.221 -179.802 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 65.5 m-80 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.179 0.514 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.6 t -101.14 139.26 37.07 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.166 -0.959 . . . . 0.0 110.136 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.405 ' HA ' ' OE2' ' A' ' 9' ' ' GLU . 60.9 mttm -61.96 -40.5 95.8 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.275 -0.89 . . . . 0.0 110.23 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.472 ' O ' ' O ' ' A' ' 5' ' ' ALA . 48.6 ttt180 -62.61 160.12 14.63 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.308 -0.87 . . . . 0.0 110.117 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.472 ' O ' ' O ' ' A' ' 4' ' ' ARG . . . 48.27 100.2 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.279 -0.888 . . . . 0.0 110.264 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.2 t -70.76 -28.57 64.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -59.7 -39.53 84.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.469 ' HD2' ' HB3' ' A' ' 5' ' ' ALA . 85.6 mtt180 -60.55 -42.27 96.21 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.314 -0.866 . . . . 0.0 110.116 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.405 ' OE2' ' HA ' ' A' ' 3' ' ' LYS . 97.6 mt-10 -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.295 -0.878 . . . . 0.0 110.019 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.38 -3.3 85.36 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.37 174.4 7.86 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 94.4 mt-10 -113.15 137.07 52.0 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.246 -1.15 . . . . 0.0 110.353 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.929 ' C ' HD22 ' A' ' 14' ' ' LEU . 15.7 m -85.39 124.09 31.59 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.28 -0.888 . . . . 0.0 109.99 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.929 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.3 mm? -124.57 146.15 49.2 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.13 -0.981 . . . . 0.0 110.161 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -63.74 -37.06 85.95 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.26 -0.9 . . . . 0.0 109.99 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 18' ' ' ILE . 37.2 ptt180 -137.01 58.12 1.73 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.23 -0.919 . . . . 0.0 109.607 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.577 ' C ' HG23 ' A' ' 18' ' ' ILE . 53.8 t -51.73 122.85 8.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.474 -0.766 . . . . 0.0 110.837 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.577 HG23 ' C ' ' A' ' 17' ' ' CYS . 19.4 pt -158.32 163.71 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.306 -0.871 . . . . 0.0 110.104 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.02 -145.62 16.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.73 -29.99 71.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.299 -1.118 . . . . 0.0 110.633 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 36' ' ' PHE . 95.5 m-85 -60.83 135.2 57.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.925 . . . . 0.0 110.422 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.46 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 98.0 m-70 -104.76 128.98 53.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.284 -0.885 . . . . 0.0 109.596 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.6 ttpt -81.32 115.76 20.84 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.144 -0.972 . . . . 0.0 110.828 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.668 HD11 ' HB2' ' A' ' 35' ' ' LYS . 11.1 mt -77.24 -47.4 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 108.868 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.41 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -158.79 -168.38 20.82 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.67 -1.772 . . . . 0.0 108.67 179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.432 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 0.9 OUTLIER -94.08 158.33 15.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.071 -1.252 . . . . 0.0 110.154 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.547 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 57.4 m -85.07 -163.7 0.88 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.207 -0.933 . . . . 0.0 110.668 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 68.7 m-20 -63.18 -33.01 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 111.197 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.643 ' CE2' ' CG ' ' A' ' 30' ' ' ARG . 72.7 t80 -179.62 140.19 0.14 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.022 -1.049 . . . . 0.0 110.878 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.643 ' CG ' ' CE2' ' A' ' 29' ' ' PHE . 27.2 mmt85 49.03 25.4 1.09 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.277 -0.889 . . . . 0.0 110.658 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.547 ' CB ' ' HB2' ' A' ' 27' ' ' CYS . 33.6 m-85 -147.45 152.17 37.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.172 -0.955 . . . . 0.0 110.258 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.465 ' HE3' ' HB3' ' A' ' 17' ' ' CYS . 52.4 mtmt -115.41 155.31 27.65 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.21 -0.931 . . . . 0.0 110.181 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 18.0 t -98.91 125.23 44.27 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.427 -0.795 . . . . 0.0 110.327 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.2 m -132.63 163.88 27.93 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.279 -0.888 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.668 ' HB2' HD11 ' A' ' 24' ' ' ILE . 87.8 tttt -131.93 140.56 49.06 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.365 -0.834 . . . . 0.0 109.97 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.563 ' HB3' ' CE1' ' A' ' 21' ' ' PHE . 44.6 p90 -123.64 161.43 25.06 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 110.256 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.409 -179.911 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 57.5 t30 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.182 0.515 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -79.0 144.48 34.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.326 -0.859 . . . . 0.0 110.126 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -74.97 143.92 43.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.144 -0.972 . . . . 0.0 110.366 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -122.64 151.97 40.95 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.227 -0.921 . . . . 0.0 110.028 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.3 101.55 12.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.202 -0.936 . . . . 0.0 109.92 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.81 -25.57 68.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.391 -0.818 . . . . 0.0 110.194 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -64.24 -38.93 92.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.357 -0.84 . . . . 0.0 110.078 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -57.82 -34.71 69.95 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.2 -0.937 . . . . 0.0 110.037 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -58.75 -29.23 66.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.235 -0.916 . . . . 0.0 110.109 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.85 10.76 34.2 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.54 -176.81 16.16 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.2 tp10 -110.01 130.28 55.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.258 -1.143 . . . . 0.0 109.952 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.914 ' C ' HD22 ' A' ' 14' ' ' LEU . 96.7 m -106.32 134.0 50.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.304 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.914 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.4 mm? -120.75 151.4 39.61 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.361 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -67.85 -24.91 65.31 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.373 -0.829 . . . . 0.0 109.619 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.451 ' O ' ' C ' ' A' ' 17' ' ' CYS . 81.3 mtm180 -145.71 59.23 1.26 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.454 -0.779 . . . . 0.0 109.897 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.451 ' C ' ' O ' ' A' ' 16' ' ' ARG . 38.4 t -36.24 122.08 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.572 -0.705 . . . . 0.0 110.555 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.471 HG22 ' N ' ' A' ' 19' ' ' GLY . 48.6 mt -77.13 170.77 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.398 -0.814 . . . . 0.0 110.152 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.471 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -58.93 -49.36 79.12 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.284 -1.527 . . . . 0.0 109.284 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 20' ' ' LEU . 16.6 tp -42.96 -40.05 2.84 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.439 -1.036 . . . . 0.0 110.231 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.455 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 68.9 m-85 -82.33 140.27 33.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.353 -0.842 . . . . 0.0 110.219 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.432 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 68.2 m80 -97.62 139.1 34.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.334 -0.854 . . . . 0.0 109.707 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 64.4 tttt -94.58 119.34 33.1 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.078 -1.014 . . . . 0.0 110.566 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.682 HD11 ' HD3' ' A' ' 35' ' ' LYS . 9.5 mt -90.59 -38.98 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 108.921 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.404 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -163.46 -163.72 16.9 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.45 HG22 ' N ' ' A' ' 27' ' ' CYS . 29.2 m -104.5 168.24 9.21 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.084 -1.245 . . . . 0.0 110.259 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.516 ' HB2' ' CB ' ' A' ' 31' ' ' PHE . 59.7 m -119.18 -171.67 2.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.38 -0.825 . . . . 0.0 109.824 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.533 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 55.1 t30 -93.77 153.65 18.19 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.192 -0.942 . . . . 0.0 110.469 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 1.8 t80 72.2 36.64 1.06 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.34 -0.85 . . . . 0.0 110.499 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 29' ' ' PHE . 99.7 mtt180 60.27 52.11 5.1 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.356 -0.84 . . . . 0.0 111.055 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.516 ' CB ' ' HB2' ' A' ' 27' ' ' CYS . 25.0 m-85 -125.74 140.99 52.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.199 -0.938 . . . . 0.0 109.831 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.505 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 34.2 mmtp -87.9 156.79 19.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.065 -1.022 . . . . 0.0 109.597 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 27.6 t -102.63 123.2 45.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.229 -0.919 . . . . 0.0 109.866 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 50.6 m -141.63 154.17 45.21 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.149 -0.97 . . . . 0.0 110.577 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.682 ' HD3' HD11 ' A' ' 24' ' ' ILE . 53.1 mtpt -134.89 159.35 41.69 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.968 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -112.04 126.1 54.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.09 -1.006 . . . . 0.0 110.377 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.313 179.907 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.249 0.547 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 91.9 p -60.28 -35.87 76.54 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.234 -0.916 . . . . 0.0 109.905 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -125.5 150.47 47.36 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.886 . . . . 0.0 109.98 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -99.95 164.82 11.84 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.184 -0.947 . . . . 0.0 110.045 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -119.15 112.73 19.88 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.231 -0.918 . . . . 0.0 110.56 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.7 m -57.96 -24.25 57.2 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.397 -0.814 . . . . 0.0 109.762 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -60.96 -36.76 80.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 109.781 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -67.64 -40.22 84.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.361 -0.837 . . . . 0.0 109.889 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -65.73 -25.71 67.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.292 -0.88 . . . . 0.0 110.048 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.89 1.58 57.28 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.801 -1.319 . . . . 0.0 109.801 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.98 -172.01 7.62 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -130.54 143.91 51.06 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.199 -1.177 . . . . 0.0 110.256 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.868 ' C ' HD22 ' A' ' 14' ' ' LEU . 30.1 m -105.21 122.88 46.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.388 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.868 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.8 mm? -122.98 144.8 49.01 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.37 -0.831 . . . . 0.0 110.1 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -57.54 -19.27 24.02 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.171 -0.955 . . . . 0.0 110.011 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' A' ' 17' ' ' CYS . 32.5 ttm180 -168.62 72.96 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.359 -0.838 . . . . 0.0 109.863 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 61.2 m -40.03 147.91 0.09 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.513 -0.742 . . . . 0.0 110.54 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.534 HG22 ' N ' ' A' ' 19' ' ' GLY . 63.0 mt -84.47 173.84 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.344 -0.847 . . . . 0.0 109.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.534 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -53.73 -46.36 67.32 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.779 ' C ' HD13 ' A' ' 20' ' ' LEU . 3.4 tm? -51.12 -44.79 61.41 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.483 ' CE2' ' CD1' ' A' ' 36' ' ' PHE . 94.6 m-85 -76.39 149.52 36.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.889 . . . . 0.0 110.829 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.451 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.9 m-70 -114.25 143.56 44.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.357 -0.839 . . . . 0.0 109.665 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 39.8 ttpt -99.36 121.6 41.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.131 -0.98 . . . . 0.0 110.75 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.445 HD11 ' HB2' ' A' ' 35' ' ' LYS . 6.0 mt -85.77 -33.51 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.321 -0.862 . . . . 0.0 108.941 179.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -167.5 -131.91 1.34 Allowed Glycine 0 N--CA 1.489 2.205 0 N-CA-C 108.907 -1.677 . . . . 0.0 108.907 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.5 m -130.19 163.41 26.73 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.134 -1.215 . . . . 0.0 110.207 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.522 ' O ' ' N ' ' A' ' 29' ' ' PHE . 1.1 t -94.87 -156.61 0.52 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 0.0 110.488 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.447 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 78.8 m-20 -64.99 56.84 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.762 -0.586 . . . . 0.0 111.021 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 88.3 t80 53.0 17.11 0.83 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.183 -0.948 . . . . 0.0 110.911 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 28' ' ' ASN . 97.1 mtt180 -125.87 -40.79 2.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.886 -1.133 . . . . 0.0 110.366 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.502 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 99.1 m-85 -128.16 170.05 13.42 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.224 -0.923 . . . . 0.0 110.077 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 74.6 mmtt -87.62 157.16 19.19 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.893 . . . . 0.0 109.927 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.48 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.8 t -94.35 110.77 22.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.305 -0.872 . . . . 0.0 109.954 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 99.3 m -129.42 163.95 24.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.38 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HB2' HD11 ' A' ' 24' ' ' ILE . 61.6 tttp -131.53 132.31 44.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.352 -0.843 . . . . 0.0 110.016 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.483 ' CD1' ' CE2' ' A' ' 21' ' ' PHE . 61.1 t80 -107.26 123.64 48.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.142 -0.974 . . . . 0.0 110.264 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 117.945 -1.026 . . . . 0.0 110.25 -179.863 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 62.0 t30 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.232 0.539 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 t -134.97 139.96 45.32 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.294 -0.878 . . . . 0.0 110.192 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -64.26 -35.92 82.41 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.347 -0.845 . . . . 0.0 110.154 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.519 ' CZ ' ' HB3' ' A' ' 9' ' ' GLU . 21.1 tpt180 -126.37 156.95 39.7 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.271 -0.893 . . . . 0.0 110.239 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.477 ' N ' ' HG3' ' A' ' 4' ' ' ARG . . . -132.82 104.45 6.6 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 110.262 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.6 t -60.53 -26.24 66.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.348 -0.845 . . . . 0.0 110.076 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -65.46 -35.68 81.64 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.297 -0.877 . . . . 0.0 110.162 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.1 mmm180 -99.7 -56.06 2.49 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.957 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.519 ' HB3' ' CZ ' ' A' ' 4' ' ' ARG . 20.7 mm-40 -80.97 -26.56 36.49 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.299 -0.876 . . . . 0.0 109.969 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.468 ' CA ' ' O ' ' A' ' 6' ' ' CYS . . . -89.41 9.07 78.37 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.45 ' HA3' ' O ' ' A' ' 34' ' ' CYS . . . 57.62 -117.2 9.42 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.476 ' HG3' ' CE1' ' A' ' 36' ' ' PHE . 95.5 mt-10 -120.07 145.28 47.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.257 -1.143 . . . . 0.0 110.317 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 32' ' ' LYS . 85.4 m -93.99 125.44 38.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.272 -0.892 . . . . 0.0 109.673 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 14' ' ' LEU . 11.6 tp -128.47 164.86 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.489 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.577 ' CG ' ' CE1' ' A' ' 31' ' ' PHE . 90.9 mt-30 -73.75 -42.4 61.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.331 -0.855 . . . . 0.0 109.756 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.2 mtt-85 -122.37 63.14 0.95 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.36 -0.837 . . . . 0.0 109.48 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.469 ' C ' ' O ' ' A' ' 16' ' ' ARG . 45.3 t -34.54 118.45 0.4 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.395 0.617 . . . . 0.0 111.137 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.62 HD11 ' CD1' ' A' ' 21' ' ' PHE . 37.9 pt -59.25 168.64 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.325 -0.859 . . . . 0.0 109.999 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -77.2 -50.46 6.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.432 ' C ' ' O ' ' A' ' 19' ' ' GLY . 48.5 tp -40.91 -32.64 0.24 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.544 -0.974 . . . . 0.0 110.565 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.62 ' CD1' HD11 ' A' ' 18' ' ' ILE . 7.0 m-30 -91.99 115.48 28.11 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.442 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 62.6 t-80 -66.22 139.86 58.12 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.322 -0.861 . . . . 0.0 110.285 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 33' ' ' CYS . 39.5 ttpt -101.24 107.66 19.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.225 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.519 HG13 ' N ' ' A' ' 25' ' ' GLY . 32.3 pt -70.56 -27.48 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.27 -0.894 . . . . 0.0 109.965 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.519 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 177.7 -135.48 2.74 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -127.77 166.15 18.73 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.198 -1.178 . . . . 0.0 110.441 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.908 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 74.4 m -100.63 -176.96 3.34 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.655 -0.653 . . . . 0.0 109.684 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.491 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 64.3 t30 -80.67 52.04 1.61 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.009 -1.057 . . . . 0.0 109.52 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.491 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 79.5 t80 -179.91 176.91 0.71 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.691 -0.63 . . . . 0.0 109.893 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.433 ' N ' ' CG ' ' A' ' 29' ' ' PHE . 91.1 mmt-85 -53.59 -16.83 1.73 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.13 -0.981 . . . . 0.0 110.887 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 15' ' ' GLN . 7.1 m-30 -76.64 167.13 22.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.025 -1.047 . . . . 0.0 110.357 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 43.3 mmtm -120.32 161.37 21.26 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 110.195 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 83.1 m -86.35 133.66 33.78 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.138 -0.976 . . . . 0.0 110.409 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.45 ' O ' ' HA3' ' A' ' 11' ' ' GLY . 62.6 m -141.36 147.17 37.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.895 . . . . 0.0 110.305 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HD2' HG21 ' A' ' 24' ' ' ILE . 51.2 mtpt -107.93 127.86 54.12 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.348 -0.845 . . . . 0.0 110.287 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.612 ' HB2' ' CZ ' ' A' ' 21' ' ' PHE . 41.0 p90 -126.48 162.75 24.89 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.159 -0.963 . . . . 0.0 110.128 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.163 179.842 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 49.5 p-10 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.214 0.531 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 98.8 p -141.54 153.48 44.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.335 -0.853 . . . . 0.0 110.38 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.463 ' HD2' ' HG2' ' A' ' 9' ' ' GLU . 33.5 ttpt -112.82 155.9 23.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.342 -0.849 . . . . 0.0 110.088 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.672 ' O ' ' HB3' ' A' ' 5' ' ' ALA . 35.4 ttm180 -160.03 158.07 29.83 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.106 -0.996 . . . . 0.0 110.438 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.672 ' HB3' ' O ' ' A' ' 4' ' ' ARG . . . 66.14 104.86 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.255 -0.903 . . . . 0.0 110.358 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.9 t -61.0 -24.98 66.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.184 -0.947 . . . . 0.0 109.716 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -70.15 -29.37 66.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.399 -0.813 . . . . 0.0 109.711 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -67.79 -33.45 74.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.3 -0.875 . . . . 0.0 110.166 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.634 ' HB3' HD13 ' A' ' 24' ' ' ILE . 52.7 mt-10 -59.94 -26.58 66.08 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.263 -0.898 . . . . 0.0 110.269 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.76 -12.52 68.54 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.27 179.87 53.34 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.524 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 79.6 mm-40 -122.36 147.03 46.76 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.225 -1.162 . . . . 0.0 110.085 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.648 ' C ' HD22 ' A' ' 14' ' ' LEU . 74.9 m -86.16 124.22 32.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.21 -0.931 . . . . 0.0 110.106 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.765 HD22 ' N ' ' A' ' 14' ' ' LEU . 3.1 mm? -110.94 139.34 46.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.553 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.539 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 29.3 pt20 -65.28 -26.55 68.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.324 -0.86 . . . . 0.0 109.894 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' CYS . 76.3 mtm-85 -140.86 55.82 1.57 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.414 -0.804 . . . . 0.0 109.66 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' ARG . 15.9 t -38.69 143.86 0.13 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.574 -0.704 . . . . 0.0 110.589 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.581 HD12 HD12 ' A' ' 20' ' ' LEU . 40.4 pt -120.86 175.74 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.321 -0.862 . . . . 0.0 110.137 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -55.48 -48.13 72.1 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.581 HD12 HD12 ' A' ' 18' ' ' ILE . 94.9 mt -44.14 -37.55 3.18 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.445 -1.032 . . . . 0.0 110.223 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -99.16 116.7 31.96 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.385 -0.822 . . . . 0.0 110.443 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -71.55 136.71 47.59 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.942 . . . . 0.0 109.568 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.522 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 86.3 tttt -86.56 100.9 12.73 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.069 -1.02 . . . . 0.0 110.487 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.634 HD13 ' HB3' ' A' ' 9' ' ' GLU . 13.8 tt -63.03 -41.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.347 -0.846 . . . . 0.0 109.835 179.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.569 ' N ' HG23 ' A' ' 24' ' ' ILE . . . -158.63 -132.49 1.4 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.48 HG22 ' CE ' ' A' ' 23' ' ' LYS . 38.9 p -138.77 138.61 37.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.235 -1.156 . . . . 0.0 110.047 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.487 ' HB3' ' O ' ' A' ' 31' ' ' PHE . 1.4 t -98.1 -159.64 0.75 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.167 -0.958 . . . . 0.0 109.64 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.525 ' OD1' ' N ' ' A' ' 31' ' ' PHE . 22.1 p30 -51.94 164.17 0.29 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.512 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -59.35 -12.62 6.09 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.98 -1.075 . . . . 0.0 111.346 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.605 ' HG3' ' CE1' ' A' ' 31' ' ' PHE . 46.7 tpt85 -98.78 -10.28 23.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.869 -1.144 . . . . 0.0 110.693 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.605 ' CE1' ' HG3' ' A' ' 30' ' ' ARG . 87.7 m-85 -144.38 154.63 43.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.959 -1.088 . . . . 0.0 110.647 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 87.3 mttt -106.91 155.22 19.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.444 ' HB2' ' C ' ' A' ' 25' ' ' GLY . 27.1 m -89.09 122.94 32.9 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.111 -0.993 . . . . 0.0 110.852 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.715 ' HB2' HD23 ' A' ' 14' ' ' LEU . 96.7 m -141.59 161.94 36.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.34 -0.85 . . . . 0.0 110.157 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -140.94 157.09 45.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.242 -0.911 . . . . 0.0 110.231 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.7 t80 -108.71 135.56 49.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.217 -0.927 . . . . 0.0 110.091 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.44 ' HG3' ' OXT' ' A' ' 37' ' ' GLN . 8.2 tp60 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.069 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.9 m120 . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.264 0.554 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.5 p -53.67 -32.0 49.85 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.177 -0.952 . . . . 0.0 110.041 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -84.44 141.04 31.1 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.297 -0.877 . . . . 0.0 110.011 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -69.82 160.17 32.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.26 -0.9 . . . . 0.0 110.577 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -110.77 115.74 30.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.352 -0.843 . . . . 0.0 110.36 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.0 t -57.49 -20.92 34.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.918 . . . . 0.0 110.139 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -69.92 -42.68 72.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.841 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -63.77 -34.24 77.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.374 -0.829 . . . . 0.0 109.944 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.415 ' OE1' ' SG ' ' A' ' 33' ' ' CYS . 97.7 mt-10 -64.37 -36.24 83.5 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.359 -0.838 . . . . 0.0 110.322 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.89 -4.58 28.96 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.21 -173.0 49.58 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -123.78 150.98 43.81 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.224 -1.162 . . . . 0.0 110.24 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.851 ' C ' HD22 ' A' ' 14' ' ' LEU . 25.7 m -92.78 116.17 28.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.207 -0.933 . . . . 0.0 110.311 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.851 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.2 mm? -121.37 132.89 55.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.209 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -53.54 -32.72 51.87 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.159 -0.963 . . . . 0.0 109.844 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 -150.89 64.72 0.92 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.348 -0.845 . . . . 0.0 110.25 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.512 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 19.3 p -55.16 168.77 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 110.402 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.541 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 41.4 pt -95.45 159.74 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.45 -0.781 . . . . 0.0 110.272 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.461 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -52.73 -45.87 60.13 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.541 ' HB2' ' CD1' ' A' ' 18' ' ' ILE . 9.9 mp -37.48 -36.02 0.15 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.858 -0.79 . . . . 0.0 110.451 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 8.7 m-30 -88.54 116.05 26.5 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.438 -0.789 . . . . 0.0 110.108 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.483 ' N ' ' O ' ' A' ' 35' ' ' LYS . 60.2 t-80 -68.64 141.95 55.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.046 -1.034 . . . . 0.0 109.95 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 38.2 ttmt -90.93 114.44 26.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.096 -1.002 . . . . 0.0 110.176 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.9 mt -78.15 -43.37 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.273 -0.892 . . . . 0.0 108.598 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.414 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -163.69 -141.7 3.2 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 43.0 p -131.18 154.83 47.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.249 -1.148 . . . . 0.0 110.361 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 64.8 m -83.88 -166.84 1.52 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.25 -0.906 . . . . 0.0 110.238 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.454 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 59.3 t30 -39.69 -49.51 2.26 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.529 -0.732 . . . . 0.0 110.736 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.454 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 89.6 t80 -178.83 -59.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 111.025 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -66.48 -43.25 85.96 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.186 -0.946 . . . . 0.0 111.383 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.464 ' O ' ' HB2' ' A' ' 27' ' ' CYS . 93.3 m-85 -90.05 162.57 15.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.994 -1.067 . . . . 0.0 111.068 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 46.5 mttm -117.38 165.06 13.94 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.461 -0.774 . . . . 0.0 109.522 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 13.8 t -99.17 113.15 25.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.992 -1.068 . . . . 0.0 110.473 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.5 m -130.76 131.88 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.358 -0.839 . . . . 0.0 109.774 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 22' ' ' HIS . 80.9 tttt -134.98 155.66 50.38 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.233 -0.917 . . . . 0.0 110.573 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -95.14 137.11 34.63 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.332 -0.855 . . . . 0.0 110.068 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.291 179.931 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.3 m120 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.358 0.599 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.4 t -133.73 132.85 41.07 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.248 -0.908 . . . . 0.0 110.121 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -57.82 -32.94 68.09 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.16 -0.963 . . . . 0.0 110.022 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -117.92 156.71 27.98 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.347 -0.846 . . . . 0.0 110.088 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -105.07 114.8 29.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.22 -0.925 . . . . 0.0 110.273 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.1 t -60.99 -16.73 46.42 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -76.92 -40.08 48.47 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.221 -0.924 . . . . 0.0 109.717 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -60.25 -38.75 84.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.416 -0.803 . . . . 0.0 110.017 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -66.18 -37.12 84.84 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.273 -0.892 . . . . 0.0 110.079 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.81 13.08 21.1 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -86.16 -169.67 46.17 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -126.57 148.02 49.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.329 -1.101 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.663 ' C ' HD22 ' A' ' 14' ' ' LEU . 97.0 m -102.22 121.96 43.26 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.866 HD23 ' HB2' ' A' ' 34' ' ' CYS . 3.0 mm? -110.67 147.08 35.07 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.23 -0.918 . . . . 0.0 110.54 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.603 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 27.9 pt20 -75.07 -25.6 58.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.264 -0.897 . . . . 0.0 109.936 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 17' ' ' CYS . 99.3 mtt180 -147.14 64.75 1.16 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.4 -0.812 . . . . 0.0 110.19 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 73.7 m -38.13 157.28 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.388 -0.82 . . . . 0.0 110.898 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CD1' ' HB2' ' A' ' 20' ' ' LEU . 43.7 pt -127.38 172.67 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.393 -0.817 . . . . 0.0 109.943 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -46.84 -46.51 19.2 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.538 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 3.8 mm? -49.68 -36.23 24.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.518 -0.99 . . . . 0.0 110.703 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 53.2 m-85 -111.37 140.93 45.54 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.059 -179.122 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -112.93 134.25 54.53 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.33 -0.857 . . . . 0.0 109.353 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 34.9 ttpt -67.27 123.1 19.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.199 -0.938 . . . . 0.0 111.433 -178.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.2 mm -90.65 -35.38 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.438 ' C ' ' HB3' ' A' ' 33' ' ' CYS . . . -152.42 -133.17 1.9 Allowed Glycine 0 N--CA 1.486 1.997 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.412 HG22 ' N ' ' A' ' 27' ' ' CYS . 17.5 m -134.28 166.53 22.6 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.163 -1.198 . . . . 0.0 111.031 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 33' ' ' CYS . 91.2 m -143.29 -164.17 1.8 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.651 -0.656 . . . . 0.0 109.411 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.45 ' C ' ' O ' ' A' ' 27' ' ' CYS . 20.7 t-20 -40.53 155.45 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.804 . . . . 0.0 109.961 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -49.97 -35.48 24.45 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.16 -0.962 . . . . 0.0 111.017 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.41 ' NH1' ' OD1' ' A' ' 28' ' ' ASN . 91.8 mtm-85 -94.46 6.68 48.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.958 -1.089 . . . . 0.0 110.68 -179.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.603 ' CE1' ' HB3' ' A' ' 15' ' ' GLN . 95.9 m-85 -139.0 155.0 48.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.179 -0.951 . . . . 0.0 110.442 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.532 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 63.2 mttp -129.01 156.66 43.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.99 179.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.53 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 50.5 t -79.34 119.19 22.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.312 -0.868 . . . . 0.0 110.353 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.866 ' HB2' HD23 ' A' ' 14' ' ' LEU . 32.9 m -139.31 133.07 30.69 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 110.215 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -124.29 155.02 39.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.177 -0.952 . . . . 0.0 110.156 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -80.85 139.52 35.91 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.346 -0.846 . . . . 0.0 110.108 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 117.936 -1.031 . . . . 0.0 110.233 -179.943 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 63.4 t30 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.28 0.562 . . . . 0.0 110.186 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 t -54.64 -50.14 68.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.242 -0.911 . . . . 0.0 109.944 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -61.84 150.19 37.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.233 -0.917 . . . . 0.0 109.825 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -122.8 151.24 41.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.141 -0.974 . . . . 0.0 110.691 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 1.025 ' HB1' ' CE1' ' A' ' 7' ' ' TYR . . . -103.6 121.23 42.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.563 -0.711 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.3 m -76.42 -16.6 59.66 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.199 -0.938 . . . . 0.0 110.067 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 1.025 ' CE1' ' HB1' ' A' ' 5' ' ' ALA . 50.9 p90 -80.23 -46.53 16.11 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.166 -0.959 . . . . 0.0 109.895 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.636 ' HG3' ' CE2' ' A' ' 7' ' ' TYR . 57.4 mtt180 -49.78 -36.52 26.37 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.59 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -60.68 -37.84 82.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.424 -0.797 . . . . 0.0 109.927 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.94 4.46 55.53 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -82.69 -158.82 25.28 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.511 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 85.4 tt0 -143.41 135.29 26.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -1.171 . . . . 0.0 110.211 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.987 ' C ' HD22 ' A' ' 14' ' ' LEU . 89.2 m -83.1 136.26 34.53 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.159 -0.963 . . . . 0.0 110.119 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.987 HD22 ' C ' ' A' ' 13' ' ' CYS . 3.3 mm? -127.87 134.69 49.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.146 -0.971 . . . . 0.0 110.358 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.541 ' HB3' ' CE2' ' A' ' 31' ' ' PHE . 15.2 pt20 -59.98 -24.63 64.6 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.338 -0.851 . . . . 0.0 110.353 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.427 ' O ' ' C ' ' A' ' 17' ' ' CYS . 89.2 mmt-85 -142.65 50.58 1.46 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 109.981 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.427 ' C ' ' O ' ' A' ' 16' ' ' ARG . 12.6 t -42.15 138.85 1.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.367 -0.833 . . . . 0.0 110.387 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.9 pt -108.62 176.78 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 110.077 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 20' ' ' LEU . . . -53.47 -49.1 58.46 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 19' ' ' GLY . 15.7 tp -41.36 -29.87 0.16 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.505 -0.997 . . . . 0.0 110.425 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.96 113.75 26.73 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.279 -0.888 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.499 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 93.0 m-70 -67.83 148.45 51.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.237 -0.914 . . . . 0.0 109.521 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 33' ' ' CYS . 37.0 ttpt -110.6 111.79 23.24 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.173 -0.954 . . . . 0.0 110.786 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 7.0 mt -71.28 -41.85 74.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.205 -0.934 . . . . 0.0 108.587 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -160.75 -156.26 8.15 Favored Glycine 0 N--CA 1.488 2.153 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 54.5 p -116.5 142.56 46.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.135 -1.215 . . . . 0.0 109.883 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.425 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 72.8 m -87.5 179.96 6.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.946 . . . . 0.0 109.999 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' A' ' 29' ' ' PHE . 63.9 t30 -62.48 151.27 37.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.162 -0.961 . . . . 0.0 110.449 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.517 ' CB ' ' O ' ' A' ' 28' ' ' ASN . 2.4 t80 71.41 -140.46 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.294 -0.879 . . . . 0.0 110.642 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -98.22 3.89 48.9 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.171 -0.956 . . . . 0.0 110.64 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.541 ' CE2' ' HB3' ' A' ' 15' ' ' GLN . 75.9 m-85 -81.24 140.79 34.69 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.093 -1.005 . . . . 0.0 110.431 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HD2' ' N ' ' A' ' 32' ' ' LYS . 11.4 mptt -100.07 161.35 13.66 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.204 -0.935 . . . . 0.0 110.282 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 84.1 m -99.84 123.82 44.5 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.313 -0.867 . . . . 0.0 109.853 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 54.9 m -130.19 163.65 26.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.097 -1.002 . . . . 0.0 110.609 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -127.83 133.4 49.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.252 -0.905 . . . . 0.0 110.424 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -88.8 138.6 31.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.866 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.292 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.231 0.539 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.8 m -119.98 149.19 42.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.245 -0.909 . . . . 0.0 110.306 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.65 -41.51 73.71 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.222 -0.924 . . . . 0.0 110.054 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -142.84 149.37 38.49 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.35 -0.844 . . . . 0.0 109.946 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.93 108.19 11.18 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.12 -0.987 . . . . 0.0 110.529 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.6 t -64.72 -22.88 67.08 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.221 -0.924 . . . . 0.0 109.771 179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -62.98 -44.64 95.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.328 -0.857 . . . . 0.0 109.825 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.7 tpp180 -58.35 -41.08 83.9 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.343 -0.848 . . . . 0.0 109.995 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.62 ' OE1' HG21 ' A' ' 24' ' ' ILE . 93.5 mt-10 -63.79 -24.19 67.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.317 -0.864 . . . . 0.0 110.159 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.28 8.56 83.37 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.77 177.96 7.64 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.413 ' O ' ' CD2' ' A' ' 14' ' ' LEU . 41.1 tt0 -116.71 127.41 54.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.182 -1.187 . . . . 0.0 110.07 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.601 ' C ' HD22 ' A' ' 14' ' ' LEU . 60.1 m -93.57 119.08 32.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.177 -0.952 . . . . 0.0 110.308 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.839 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.0 mm? -114.74 154.95 27.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.161 -0.962 . . . . 0.0 110.069 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.609 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 30.4 mt-30 -74.22 -17.24 60.91 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.25 -0.906 . . . . 0.0 110.021 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 15' ' ' GLN . 50.3 mtt180 -152.16 57.17 0.84 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.181 -0.949 . . . . 0.0 110.266 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 72.0 m -37.16 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.573 -0.704 . . . . 0.0 110.447 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.514 HG22 ' N ' ' A' ' 19' ' ' GLY . 72.3 mt -89.79 171.1 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.247 -0.908 . . . . 0.0 109.759 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.514 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -60.05 -45.49 95.85 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.41 ' HA ' HD12 ' A' ' 20' ' ' LEU . 29.0 tp -48.01 -43.64 30.11 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.611 -0.935 . . . . 0.0 110.951 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 66.8 m-85 -72.97 146.82 45.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.304 -0.873 . . . . 0.0 110.944 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.502 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 73.8 m80 -109.93 159.44 17.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.514 -0.741 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 60.6 tttm -94.99 108.32 20.38 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.03 -1.044 . . . . 0.0 110.7 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.62 HG21 ' OE1' ' A' ' 9' ' ' GLU . 20.7 mm -77.28 -42.19 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.885 . . . . 0.0 108.729 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.423 ' O ' ' NZ ' ' A' ' 23' ' ' LYS . . . -153.41 -129.28 1.36 Allowed Glycine 0 N--CA 1.486 2.027 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.5 p -141.39 155.37 45.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.11 -1.23 . . . . 0.0 110.482 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.451 ' O ' ' C ' ' A' ' 28' ' ' ASN . 97.4 m -123.16 -167.79 1.66 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.397 -0.814 . . . . 0.0 109.757 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.451 ' C ' ' O ' ' A' ' 27' ' ' CYS . 19.5 m120 -39.57 147.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.607 -0.683 . . . . 0.0 110.169 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.408 ' C ' ' O ' ' A' ' 28' ' ' ASN . 78.7 t80 -42.39 -41.17 2.78 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.2 -0.938 . . . . 0.0 110.792 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -85.24 4.35 35.15 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.114 -0.991 . . . . 0.0 110.853 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.609 ' CE2' ' CG ' ' A' ' 15' ' ' GLN . 96.0 m-85 -139.96 157.03 46.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.071 -1.018 . . . . 0.0 110.66 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.505 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 57.5 mttp -127.39 157.64 39.45 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.426 -0.797 . . . . 0.0 109.825 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 44.5 t -80.93 127.13 32.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.273 -0.892 . . . . 0.0 110.924 -179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 67.7 m -141.6 140.32 33.32 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.503 -0.748 . . . . 0.0 109.916 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -136.21 152.7 51.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.15 -0.969 . . . . 0.0 110.329 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.562 ' CE1' ' CZ ' ' A' ' 21' ' ' PHE . 67.5 m-85 -61.73 167.38 3.64 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.303 -0.873 . . . . 0.0 110.015 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.142 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 4' ' ' ARG . 83.7 m-20 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.248 0.547 . . . . 0.0 110.29 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.8 t -49.83 -47.4 51.54 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.16 -0.962 . . . . 0.0 110.182 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -60.3 -29.83 69.08 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.234 -0.916 . . . . 0.0 110.227 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 1' ' ' ASN . 64.1 mtp180 -74.83 161.31 29.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.247 -0.908 . . . . 0.0 109.981 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -113.82 114.35 26.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.149 -0.97 . . . . 0.0 110.462 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.6 m -61.57 -22.25 65.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.774 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -66.71 -44.02 82.76 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.388 -0.82 . . . . 0.0 109.975 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -59.75 -40.63 88.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.409 -0.807 . . . . 0.0 109.97 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' OE2' ' NH2' ' A' ' 4' ' ' ARG . 94.1 mt-10 -67.95 -27.62 66.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.338 -0.851 . . . . 0.0 110.152 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.04 11.07 59.15 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.18 -177.68 9.8 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -125.07 145.69 49.8 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.287 -1.125 . . . . 0.0 110.275 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.539 ' O ' HD23 ' A' ' 14' ' ' LEU . 84.8 m -124.46 131.0 53.5 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.361 -0.837 . . . . 0.0 110.141 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.539 HD23 ' O ' ' A' ' 13' ' ' CYS . 25.3 mt -120.02 146.08 46.21 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -55.66 -28.05 53.33 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.162 -0.961 . . . . 0.0 108.671 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.46 ' O ' HG13 ' A' ' 18' ' ' ILE . 99.1 mtt180 -135.71 63.58 1.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.45 ' C ' HG13 ' A' ' 18' ' ' ILE . 42.3 t -49.56 116.74 1.88 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.53 -0.731 . . . . 0.0 111.06 -179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.593 HG22 ' N ' ' A' ' 19' ' ' GLY . 61.5 mt -151.26 172.68 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.414 -0.804 . . . . 0.0 109.499 179.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.593 ' N ' HG22 ' A' ' 18' ' ' ILE . . . 92.53 -162.02 26.53 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.4 mt -53.5 -19.96 4.31 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.388 -1.066 . . . . 0.0 110.474 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -75.57 145.45 41.21 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.282 -0.886 . . . . 0.0 110.365 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.435 ' CD2' HG12 ' A' ' 24' ' ' ILE . 35.2 p-80 -121.58 176.79 5.51 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.447 ' HE3' ' HD2' ' A' ' 32' ' ' LYS . 86.4 tttt -103.7 110.86 23.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.177 -0.952 . . . . 0.0 110.449 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 35' ' ' LYS . 7.1 mt -88.23 -34.85 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.85 . . . . 0.0 109.069 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.11 -163.25 21.73 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.176 -1.57 . . . . 0.0 109.176 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 m -94.15 165.69 12.49 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.026 -1.279 . . . . 0.0 110.614 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 31' ' ' PHE . 1.1 t -122.78 -158.55 0.79 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.379 -0.826 . . . . 0.0 110.183 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.7 p-10 -71.95 151.75 43.04 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.649 -0.657 . . . . 0.0 110.565 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 8.9 t80 48.3 -124.88 1.83 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.473 -0.767 . . . . 0.0 110.778 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -104.92 14.52 29.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.882 -1.136 . . . . 0.0 111.197 -179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.429 ' O ' ' HB3' ' A' ' 27' ' ' CYS . 60.1 m-85 -84.07 142.55 30.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.012 -1.055 . . . . 0.0 110.189 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HD2' ' HE3' ' A' ' 23' ' ' LYS . 75.2 mmtt -90.07 159.16 16.96 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.28 -0.888 . . . . 0.0 110.65 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.46 ' HA ' ' SG ' ' A' ' 13' ' ' CYS . 16.8 t -89.6 131.81 35.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.309 -0.869 . . . . 0.0 109.985 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.406 ' SG ' ' O ' ' A' ' 22' ' ' HIS . 67.3 m -149.54 137.01 20.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.155 -0.966 . . . . 0.0 110.518 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.556 ' HB2' HD11 ' A' ' 24' ' ' ILE . 58.7 mtpt -125.96 157.8 36.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.451 -0.78 . . . . 0.0 110.024 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -95.51 132.43 40.62 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.245 -0.909 . . . . 0.0 110.29 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.216 179.932 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.3 m120 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.234 0.54 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 94.2 p -149.86 155.82 40.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.234 -0.916 . . . . 0.0 110.29 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -59.34 157.88 10.23 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.185 -0.947 . . . . 0.0 109.941 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.6 mtp180 -123.35 166.86 14.61 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.182 -0.949 . . . . 0.0 109.995 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.86 112.38 15.93 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 110.437 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 80.5 m -58.52 -23.09 57.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -68.75 -44.04 74.57 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.343 -0.848 . . . . 0.0 110.267 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -65.12 -41.84 94.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -0.928 . . . . 0.0 110.143 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.65 -29.48 68.07 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.158 -0.964 . . . . 0.0 110.093 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.85 3.74 68.0 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -74.47 -169.55 22.21 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 34' ' ' CYS . 87.9 mt-10 -133.2 149.08 52.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -1.091 . . . . 0.0 109.788 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.808 ' C ' HD22 ' A' ' 14' ' ' LEU . 72.9 m -109.9 129.95 55.59 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.05 -1.031 . . . . 0.0 110.446 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.815 HD22 ' N ' ' A' ' 14' ' ' LEU . 2.9 mm? -118.98 145.65 45.65 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.355 -0.841 . . . . 0.0 110.191 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -63.13 -29.14 70.56 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.061 -1.024 . . . . 0.0 109.074 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.478 ' O ' ' C ' ' A' ' 17' ' ' CYS . 87.4 mtm180 -138.79 59.49 1.62 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.591 -0.693 . . . . 0.0 109.678 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.478 ' C ' ' O ' ' A' ' 16' ' ' ARG . 3.2 t -33.87 132.34 0.24 Allowed 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 121.5 0.667 . . . . 0.0 111.061 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.565 HG22 ' N ' ' A' ' 19' ' ' GLY . 75.5 mt -91.25 173.65 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.437 -0.789 . . . . 0.0 110.31 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.565 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -59.62 -50.89 62.85 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.695 ' C ' HD13 ' A' ' 20' ' ' LEU . 3.3 tm? -44.11 -45.53 8.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.4 -1.059 . . . . 0.0 110.045 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -80.04 135.7 36.41 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.421 -0.799 . . . . 0.0 109.995 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.438 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.5 m-70 -99.43 137.42 37.95 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.127 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.521 ' CE ' ' O ' ' A' ' 25' ' ' GLY . 85.5 tttt -88.75 119.25 29.06 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.317 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.749 HD11 ' SG ' ' A' ' 33' ' ' CYS . 37.4 pt -86.16 -30.35 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.257 -0.902 . . . . 0.0 110.124 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.53 ' N ' HG13 ' A' ' 24' ' ' ILE . . . -168.23 -135.64 1.91 Allowed Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -121.22 140.43 52.04 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.239 -1.154 . . . . 0.0 110.523 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.472 ' HB2' ' C ' ' A' ' 32' ' ' LYS . 1.6 t -110.79 -161.6 0.76 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 27' ' ' CYS . 83.5 m-20 -46.23 141.99 3.12 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 119.693 -0.803 . . . . 0.0 109.447 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.98 -21.36 0.13 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.075 -1.015 . . . . 0.0 110.797 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.487 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 16.2 tpt180 -93.24 -3.64 53.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.003 -1.061 . . . . 0.0 110.424 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -148.11 157.01 43.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.854 -1.154 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.509 ' O ' ' HA ' ' A' ' 13' ' ' CYS . 73.3 mmtt -101.88 158.34 16.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.365 -0.834 . . . . 0.0 109.69 179.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.749 ' SG ' HD11 ' A' ' 24' ' ' ILE . 7.0 t -85.85 115.07 23.27 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.143 -0.973 . . . . 0.0 110.421 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.491 ' O ' ' N ' ' A' ' 12' ' ' GLU . 85.0 m -131.96 142.57 49.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.356 -0.84 . . . . 0.0 110.07 179.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -123.72 129.1 50.57 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.989 . . . . 0.0 110.371 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -80.71 139.93 35.86 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.917 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.113 179.906 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . 0.442 ' O ' ' O ' ' A' ' 4' ' ' ARG . 82.9 m-20 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 121.321 0.581 . . . . 0.0 110.089 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 99.3 p -64.67 -29.08 70.07 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.352 -0.842 . . . . 0.0 110.361 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -66.94 -30.18 70.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.182 -0.949 . . . . 0.0 110.242 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.442 ' O ' ' O ' ' A' ' 1' ' ' ASN . 26.9 ptt-85 -144.85 141.1 28.83 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.308 -0.87 . . . . 0.0 110.03 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -112.28 110.63 20.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.293 -0.88 . . . . 0.0 110.424 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 53.5 t -59.54 -23.08 62.56 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.222 -0.924 . . . . 0.0 109.943 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -70.37 -40.18 74.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.257 -0.902 . . . . 0.0 110.004 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -66.63 -33.45 75.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.306 -0.871 . . . . 0.0 109.875 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -65.34 -34.54 78.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.412 -0.805 . . . . 0.0 110.121 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 19.78 78.09 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.61 -152.3 7.16 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -121.06 146.85 46.28 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -1.192 . . . . 0.0 109.836 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.861 ' C ' HD22 ' A' ' 14' ' ' LEU . 74.2 m -121.73 116.4 24.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.967 . . . . 0.0 110.367 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.861 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.9 mm? -120.93 147.32 45.6 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.321 -0.862 . . . . 0.0 109.764 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.438 ' OE1' ' HA ' ' A' ' 31' ' ' PHE . 16.2 mm-40 -54.78 -21.42 11.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.98 -1.075 . . . . 0.0 109.347 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -169.34 71.76 0.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.583 -0.698 . . . . 0.0 109.701 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 28.7 p -63.99 145.29 56.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.0 110.741 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 32.5 pt -141.1 159.23 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.641 -0.662 . . . . 0.0 110.153 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.57 -145.81 17.33 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.498 ' O ' ' CD2' ' A' ' 22' ' ' HIS . 26.3 mt -61.85 -16.18 48.2 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.399 -1.06 . . . . 0.0 110.228 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -72.59 135.34 45.52 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.339 -0.85 . . . . 0.0 111.028 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.515 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 94.6 m-70 -121.53 151.76 39.95 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.412 -0.805 . . . . 0.0 109.016 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.509 ' HE2' HG22 ' A' ' 26' ' ' THR . 60.2 tttm -93.54 126.64 38.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.868 -1.145 . . . . 0.0 111.66 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mt -101.49 -37.17 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.46 -148.59 5.17 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 43.5 p -136.31 149.0 48.23 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.072 -1.252 . . . . 0.0 110.469 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.835 ' SG ' ' SG ' ' A' ' 6' ' ' CYS . 8.1 m -115.69 163.91 15.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.355 -0.841 . . . . 0.0 109.732 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.52 ' O ' ' N ' ' A' ' 30' ' ' ARG . 54.8 t-20 38.98 29.72 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.432 -0.792 . . . . 0.0 110.692 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.486 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 85.1 t80 60.34 -74.75 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.437 -0.789 . . . . 0.0 110.509 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 28' ' ' ASN . 81.6 mtt180 -58.39 -49.35 77.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.2 -0.938 . . . . 0.0 110.513 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.438 ' HA ' ' OE1' ' A' ' 15' ' ' GLN . 90.5 m-85 -71.05 158.47 36.43 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.19 -0.943 . . . . 0.0 110.516 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 71.3 mmtt -108.58 168.35 9.4 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 49.0 t -107.0 133.87 51.0 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.185 -0.947 . . . . 0.0 109.787 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 96.1 m -140.52 134.69 30.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.453 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -110.79 148.65 31.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.354 -0.841 . . . . 0.0 110.401 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -81.87 145.21 30.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.223 -0.923 . . . . 0.0 109.925 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.489 ' OE1' ' CD2' ' A' ' 22' ' ' HIS . 61.6 tt0 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.263 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.247 0.546 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.6 m -64.23 -37.53 87.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.314 -0.866 . . . . 0.0 110.324 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -117.29 137.63 52.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.124 -0.985 . . . . 0.0 110.481 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.481 ' HD3' ' OE2' ' A' ' 9' ' ' GLU . 26.5 ttm180 -112.84 153.32 28.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.425 -0.797 . . . . 0.0 109.831 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.668 ' HB3' ' HD2' ' A' ' 8' ' ' ARG . . . -120.3 105.55 11.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.926 . . . . 0.0 110.212 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.9 t -52.75 -27.2 16.78 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -69.69 -33.68 72.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.363 -0.836 . . . . 0.0 110.129 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.668 ' HD2' ' HB3' ' A' ' 5' ' ' ALA . 79.8 mtt85 -73.95 -29.74 62.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.2 -0.938 . . . . 0.0 109.924 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.481 ' OE2' ' HD3' ' A' ' 4' ' ' ARG . 43.7 mt-10 -69.29 -24.42 63.95 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.72 4.52 36.71 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.425 ' CA ' ' HG2' ' A' ' 35' ' ' LYS . . . -86.78 -173.9 49.05 Favored Glycine 0 N--CA 1.49 2.233 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -124.96 142.8 51.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.21 -1.171 . . . . 0.0 110.224 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.789 ' C ' HD22 ' A' ' 14' ' ' LEU . 48.0 m -92.99 133.14 36.43 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.272 -0.892 . . . . 0.0 110.185 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.789 HD22 ' C ' ' A' ' 13' ' ' CYS . 2.9 mm? -130.8 142.45 50.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.222 -0.924 . . . . 0.0 110.142 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.455 ' CG ' ' CE2' ' A' ' 31' ' ' PHE . 89.0 mt-30 -74.27 -21.68 59.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.294 -0.879 . . . . 0.0 110.569 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.424 ' O ' ' C ' ' A' ' 17' ' ' CYS . 92.1 mtt180 -148.83 62.01 1.06 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.108 -0.995 . . . . 0.0 110.639 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.492 ' SG ' ' HB2' ' A' ' 14' ' ' LEU . 92.5 m -41.86 144.18 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.207 -0.933 . . . . 0.0 110.159 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.41 HG22 ' HD1' ' A' ' 21' ' ' PHE . 16.8 tt -119.5 176.73 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.168 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.08 -45.21 26.68 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.403 ' HB2' HG23 ' A' ' 18' ' ' ILE . 99.5 mt -52.68 -29.47 26.75 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.608 -0.936 . . . . 0.0 110.652 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.485 ' CE2' ' HB2' ' A' ' 36' ' ' PHE . 87.9 m-85 -113.38 146.06 40.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.126 -0.984 . . . . 0.0 110.542 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.448 ' O ' ' HA ' ' A' ' 34' ' ' CYS . 95.1 m-70 -106.87 134.12 50.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.736 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 33' ' ' CYS . 39.0 ttpt -92.92 97.65 10.87 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.117 -0.989 . . . . 0.0 110.617 -179.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.601 HG23 ' N ' ' A' ' 25' ' ' GLY . 18.9 tt -64.41 -43.39 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.161 -0.962 . . . . 0.0 109.832 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.601 ' N ' HG23 ' A' ' 24' ' ' ILE . . . -155.17 -148.11 4.91 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.4 p -120.99 150.11 41.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.251 -1.147 . . . . 0.0 110.133 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 32' ' ' LYS . 92.4 m -77.68 -169.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 110.423 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.439 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 81.0 m-20 -51.71 -39.75 58.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.215 -0.928 . . . . 0.0 110.481 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.552 ' CD2' ' HB2' ' A' ' 30' ' ' ARG . 60.0 t80 -179.32 150.59 0.44 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.49 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.552 ' HB2' ' CD2' ' A' ' 29' ' ' PHE . 68.2 ttt180 66.16 -59.15 0.33 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.437 -0.789 . . . . 0.0 111.127 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.475 ' N ' ' O ' ' A' ' 29' ' ' PHE . 96.6 m-85 -79.48 157.12 27.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.107 -0.996 . . . . 0.0 110.647 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.497 ' HD2' ' CD ' ' A' ' 23' ' ' LYS . 50.3 mtmt -110.14 158.33 18.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.484 -0.76 . . . . 0.0 109.989 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.529 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 37.7 t -86.89 118.21 26.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.185 -0.947 . . . . 0.0 110.464 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.448 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 55.6 m -138.71 132.4 30.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.367 -0.833 . . . . 0.0 110.024 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HG2' ' CA ' ' A' ' 11' ' ' GLY . 98.6 mttt -113.37 139.81 48.57 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.295 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HB2' ' CE2' ' A' ' 21' ' ' PHE . 91.2 t80 -108.13 142.89 37.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.324 -0.86 . . . . 0.0 110.149 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.192 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 58.9 t30 . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.204 0.526 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.0 p -70.79 -36.87 73.21 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.328 -0.857 . . . . 0.0 110.099 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -137.41 160.89 37.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.209 -0.932 . . . . 0.0 109.968 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -84.66 158.65 20.76 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.24 -0.913 . . . . 0.0 110.334 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.71 115.28 27.65 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.289 -0.882 . . . . 0.0 110.038 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.536 ' CA ' ' HA3' ' A' ' 10' ' ' GLY . 59.5 m -71.9 -15.86 62.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -73.26 -29.64 62.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.293 -0.879 . . . . 0.0 110.444 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -83.89 -45.42 13.23 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.396 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -135.23 0.78 2.86 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.208 -0.932 . . . . 0.0 110.617 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.536 ' HA3' ' CA ' ' A' ' 6' ' ' CYS . . . -56.9 -23.2 44.63 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 72.15 -99.25 0.86 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -136.78 159.11 42.83 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -1.177 . . . . 0.0 110.303 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.49 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . 57.7 m -120.24 150.04 41.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.21 -0.931 . . . . 0.0 110.655 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.719 HD12 ' H ' ' A' ' 15' ' ' GLN . 4.7 tp -148.45 160.28 43.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.351 -0.843 . . . . 0.0 109.872 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.719 ' H ' HD12 ' A' ' 14' ' ' LEU . 46.6 tt0 -69.22 -52.16 30.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.544 -0.723 . . . . 0.0 110.064 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -106.61 80.64 1.49 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.329 -0.857 . . . . 0.0 110.022 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.616 ' O ' HD13 ' A' ' 18' ' ' ILE . 7.2 t -77.11 81.07 3.63 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.616 HD13 ' O ' ' A' ' 17' ' ' CYS . 18.7 mm -136.85 166.84 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.166 -0.959 . . . . 0.0 110.487 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.414 ' N ' HG22 ' A' ' 18' ' ' ILE . . . 86.66 -128.06 8.7 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.406 ' HA ' HD12 ' A' ' 20' ' ' LEU . 23.7 tp -67.97 -32.17 72.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -1.141 . . . . 0.0 110.813 -179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CE1' ' CD1' ' A' ' 36' ' ' PHE . 90.7 m-85 -80.44 132.65 35.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.204 -0.935 . . . . 0.0 110.415 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -107.11 141.67 37.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.299 -0.875 . . . . 0.0 109.889 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.468 ' CD ' ' HD3' ' A' ' 32' ' ' LYS . 21.0 ttpt -89.42 114.01 25.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.142 -0.974 . . . . 0.0 110.473 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.411 HG13 ' HG3' ' A' ' 35' ' ' LYS . 22.7 mm -77.74 -41.89 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.309 -0.869 . . . . 0.0 108.761 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -164.12 -129.28 1.02 Allowed Glycine 0 N--CA 1.486 2.023 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 32' ' ' LYS . 38.8 p -127.13 150.4 49.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.167 -1.196 . . . . 0.0 109.855 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.476 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -84.67 -160.11 0.46 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -0.997 . . . . 0.0 111.021 -179.62 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -62.48 -42.98 99.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.86 -0.525 . . . . 0.0 110.963 -179.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.565 ' O ' ' CD2' ' A' ' 31' ' ' PHE . 81.7 t80 -177.08 143.98 0.42 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.17 -0.956 . . . . 0.0 110.543 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.538 ' O ' ' CD1' ' A' ' 31' ' ' PHE . 12.0 tpp180 52.33 19.63 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.284 -0.885 . . . . 0.0 110.255 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.565 ' CD2' ' O ' ' A' ' 29' ' ' PHE . 47.9 m-85 -149.62 154.63 38.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.236 -0.915 . . . . 0.0 110.044 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.468 ' HD3' ' CD ' ' A' ' 23' ' ' LYS . 62.8 mttp -112.5 158.1 20.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.233 -0.917 . . . . 0.0 110.455 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.0 t -85.21 124.5 31.93 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.315 -0.866 . . . . 0.0 109.838 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 65.3 m -135.54 141.59 45.25 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.181 -0.95 . . . . 0.0 110.531 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.411 ' HG3' HG13 ' A' ' 24' ' ' ILE . 58.2 mtpt -116.59 127.31 54.37 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.31 -0.869 . . . . 0.0 109.909 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.401 ' CD1' ' CE1' ' A' ' 21' ' ' PHE . 92.2 t80 -98.41 139.72 33.74 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.173 -0.954 . . . . 0.0 110.562 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.085 179.747 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 9.8 m120 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.274 0.559 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.418 ' O ' ' CD ' ' A' ' 9' ' ' GLU . 86.1 p -141.35 152.32 44.28 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.158 -0.964 . . . . 0.0 110.125 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 54.5 mttm -59.8 -38.02 80.77 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.23 -0.919 . . . . 0.0 110.333 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' A' ' 5' ' ' ALA . 27.1 mmm180 -64.8 158.28 25.37 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.264 -0.898 . . . . 0.0 110.187 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.873 ' HB1' ' CE2' ' A' ' 7' ' ' TYR . . . 54.67 95.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.308 -0.87 . . . . 0.0 109.767 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.9 m -74.73 -21.2 59.49 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.432 -0.792 . . . . 0.0 110.02 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.873 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 53.2 p90 -69.31 -44.73 71.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.413 -0.804 . . . . 0.0 109.647 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.63 ' N ' ' CD1' ' A' ' 7' ' ' TYR . 38.9 ttm180 -57.68 -42.66 84.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.37 -0.831 . . . . 0.0 109.906 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.442 ' OE1' HD13 ' A' ' 24' ' ' ILE . 41.6 mt-10 -67.02 -29.68 69.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.068 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.16 9.56 61.94 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.15 176.68 26.03 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -132.21 146.47 52.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.246 -1.15 . . . . 0.0 110.326 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.495 ' O ' HD23 ' A' ' 14' ' ' LEU . 79.1 m -103.57 130.76 51.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.255 -0.903 . . . . 0.0 109.95 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 13' ' ' CYS . 15.0 mt -112.32 141.58 45.87 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.148 -0.97 . . . . 0.0 110.499 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -56.64 -24.74 50.47 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.273 -0.892 . . . . 0.0 109.665 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.415 ' O ' ' C ' ' A' ' 17' ' ' CYS . 90.9 mtt-85 -137.91 55.12 1.78 Allowed 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.415 ' C ' ' O ' ' A' ' 16' ' ' ARG . 7.6 t -39.81 130.71 1.94 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.528 -0.733 . . . . 0.0 110.725 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.484 HG22 ' N ' ' A' ' 19' ' ' GLY . 40.7 mm -100.23 171.03 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.473 -0.767 . . . . 0.0 110.203 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.484 ' N ' HG22 ' A' ' 18' ' ' ILE . . . -59.09 -46.41 93.8 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.403 ' C ' ' O ' ' A' ' 19' ' ' GLY . 34.0 tp -42.1 -37.92 1.54 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.607 -0.937 . . . . 0.0 110.179 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.457 ' HB3' ' HB3' ' A' ' 34' ' ' CYS . 88.4 m-85 -89.22 113.55 24.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.357 -0.839 . . . . 0.0 110.433 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.483 ' O ' ' N ' ' A' ' 35' ' ' LYS . 85.3 t60 -62.53 138.84 58.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.284 -0.885 . . . . 0.0 109.834 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -99.54 112.13 24.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 110.451 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.442 HD13 ' OE1' ' A' ' 9' ' ' GLU . 15.1 mt -72.63 -39.61 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.289 -0.882 . . . . 0.0 108.658 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.412 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . -174.56 -129.7 1.21 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.8 p -120.22 155.8 32.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.209 -1.171 . . . . 0.0 110.028 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' PHE . 0.6 OUTLIER -94.59 -159.38 0.7 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -0.999 . . . . 0.0 110.438 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 29' ' ' PHE . 43.9 t30 -43.09 -53.12 5.08 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.699 -0.625 . . . . 0.0 110.222 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.448 ' HB2' ' O ' ' A' ' 28' ' ' ASN . 58.7 t80 -178.66 -61.84 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.49 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -68.8 -34.63 75.85 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.27 -0.894 . . . . 0.0 110.98 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.495 ' O ' ' CB ' ' A' ' 27' ' ' CYS . 91.2 m-85 -103.51 156.11 18.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.018 -1.051 . . . . 0.0 110.591 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -102.7 159.25 15.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.389 -0.819 . . . . 0.0 109.936 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.412 ' HB3' ' H ' ' A' ' 25' ' ' GLY . 34.2 t -82.88 127.97 33.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.24 -0.913 . . . . 0.0 110.122 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 21' ' ' PHE . 57.5 m -134.01 152.86 52.02 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.148 -0.97 . . . . 0.0 110.404 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.483 ' N ' ' O ' ' A' ' 22' ' ' HIS . 52.9 tttp -127.62 119.77 26.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.357 -0.839 . . . . 0.0 110.156 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -77.22 141.38 40.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.245 -0.91 . . . . 0.0 110.264 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.441 ' CG ' ' OXT' ' A' ' 37' ' ' GLN . 3.6 tt0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 117.934 -1.032 . . . . 0.0 110.167 179.847 . . . . . . . . 1 1 . 1 stop_ save_