data_2a3d_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 2a3d _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.212 0.529 . . . . 0.0 110.157 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -54.17 -24.98 30.85 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -59.19 -57.81 11.42 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.22 -1.165 . . . . 0.0 110.048 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 59.8 t-105 -67.37 -10.96 56.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.291 -0.881 . . . . 0.0 110.485 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.1 -42.47 72.67 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.036 -1.04 . . . . 0.0 110.289 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -77.24 -32.3 55.63 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.223 -0.923 . . . . 0.0 110.332 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -64.87 -28.54 69.61 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.199 -0.938 . . . . 0.0 110.251 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -75.02 -33.39 61.78 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.192 -0.942 . . . . 0.0 110.153 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -70.74 -23.12 62.37 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.168 -0.957 . . . . 0.0 110.13 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.99 -44.63 30.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.214 -0.929 . . . . 0.0 110.184 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.437 ' O ' ' CG2' ' A' ' 14' ' ' ILE . 1.3 mm? -58.07 -30.17 66.01 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.055 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.76 -28.42 40.4 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.067 -1.021 . . . . 0.0 109.875 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.09 73.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.295 -0.878 . . . . 0.0 110.115 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.437 ' CG2' ' O ' ' A' ' 11' ' ' LEU . 65.7 mt -80.99 -10.63 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.27 -0.894 . . . . 0.0 110.344 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -31.59 56.6 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.848 -1.158 . . . . 0.0 110.755 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.5 m -85.27 -49.32 8.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.1 -1.0 . . . . 0.0 110.705 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -55.97 -49.45 73.53 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.211 -0.931 . . . . 0.0 110.307 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.545 ' HG ' ' CD2' ' A' ' 70' ' ' TYR . 1.1 tp -69.93 -8.41 48.58 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.171 -0.956 . . . . 0.0 110.579 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -71.12 -20.24 62.35 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.966 -1.084 . . . . 0.0 109.399 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 21' ' ' LEU . . . -97.65 -74.62 0.57 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.306 -0.872 . . . . 0.0 110.312 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.544 ' CD1' ' CG ' ' A' ' 70' ' ' TYR . 57.4 mt 61.43 12.78 4.57 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.289 -0.882 . . . . 0.0 110.831 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.82 -35.27 58.58 Favored Glycine 0 N--CA 1.483 1.805 0 N-CA-C 105.468 -3.053 . . . . 0.0 105.468 176.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.484 ' O ' ' N ' ' A' ' 25' ' ' GLU . . . -84.08 -36.29 13.41 Favored Glycine 0 N--CA 1.479 1.523 0 N-CA-C 107.088 -2.405 . . . . 0.0 107.088 177.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.475 ' HA ' ' CD2' ' A' ' 28' ' ' LEU . 87.9 p 47.07 -82.73 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.484 ' N ' ' O ' ' A' ' 23' ' ' GLY . 35.1 tt0 -37.93 -44.77 0.81 Allowed 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.696 -0.628 . . . . 0.0 112.183 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -95.63 -5.14 43.09 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.94 -1.1 . . . . 0.0 110.858 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 24' ' ' SER . 3.2 mm-40 -95.52 -73.8 0.58 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.158 -0.964 . . . . 0.0 111.322 -179.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.475 ' CD2' ' HA ' ' A' ' 24' ' ' SER . 0.5 OUTLIER -81.68 15.28 2.21 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.784 -1.197 . . . . 0.0 111.699 -178.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.429 ' CB ' ' O ' ' A' ' 25' ' ' GLU . . . -75.03 -47.27 29.82 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 176.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.37 -26.83 66.67 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.53 ' CZ ' ' CD1' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -49.39 -55.46 12.94 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.403 -0.811 . . . . 0.0 109.593 178.508 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -49.81 -42.46 47.1 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.53 -0.731 . . . . 0.0 109.854 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.96 -18.0 62.66 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.856 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -69.76 0.58 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.245 -0.909 . . . . 0.0 110.419 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -43.14 -27.93 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.763 0 O-C-N 121.643 -0.66 . . . . 0.0 110.502 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.77 -47.29 75.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.891 -1.131 . . . . 0.0 109.12 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -75.66 -2.92 31.71 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.407 -0.808 . . . . 0.0 110.193 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.435 ' O ' ' CD1' ' A' ' 42' ' ' LEU . 0.7 OUTLIER -80.05 -22.21 42.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.053 -1.029 . . . . 0.0 109.926 179.822 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -92.09 -52.17 4.83 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.227 -0.92 . . . . 0.0 109.791 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.0 m -59.36 -30.12 68.17 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.292 -0.88 . . . . 0.0 110.283 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 1.2 tt0 -88.04 -33.38 18.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.186 -0.946 . . . . 0.0 110.446 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.448 ' HG ' ' CG2' ' A' ' 53' ' ' VAL . 1.2 tp -46.12 -31.68 2.5 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.37 -0.831 . . . . 0.0 110.938 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.12 -29.26 14.66 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.126 -0.984 . . . . 0.0 110.273 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -95.71 8.2 44.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.308 -0.87 . . . . 0.0 111.304 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.405 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 1.2 p90 -78.94 -15.79 57.84 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.855 -1.153 . . . . 0.0 110.679 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.89 -158.87 0.73 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.17 -0.956 . . . . 0.0 108.856 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.46 ' O ' ' HB3' ' A' ' 48' ' ' LYS . . . -53.99 -49.75 57.72 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 108.003 -2.039 . . . . 0.0 108.003 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.46 ' HB3' ' O ' ' A' ' 47' ' ' GLY . 0.7 OUTLIER 169.73 54.26 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.827 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.429 ' O ' ' CG1' ' A' ' 53' ' ' VAL . . . -59.91 92.2 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.475 ' N ' ' CD ' ' A' ' 51' ' ' PRO . 3.8 m-80 -87.15 -49.03 0.47 Allowed Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.326 -1.102 . . . . 0.0 110.509 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.475 ' CD ' ' N ' ' A' ' 50' ' ' ASN . 49.5 Cg_endo -80.31 -42.62 0.14 Allowed 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.504 1.265 . . . . 0.0 109.753 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -52.35 -66.14 0.44 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.439 -0.788 . . . . 0.0 110.36 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.448 ' CG2' ' HG ' ' A' ' 42' ' ' LEU . 4.7 p -72.71 -7.24 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.01 -1.056 . . . . 0.0 110.506 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 51' ' ' PRO . 2.1 tt0 -51.31 -47.97 62.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.958 -1.089 . . . . 0.0 109.849 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.86 -33.77 51.34 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.332 -0.855 . . . . 0.0 109.647 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.01 -4.54 35.95 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.38 -0.825 . . . . 0.0 110.353 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.8 ttt85 -87.27 -23.81 24.57 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.989 -1.069 . . . . 0.0 109.499 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.24 -39.59 15.29 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.796 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -70.9 -48.57 52.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.327 -0.858 . . . . 0.0 109.882 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.436 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . . . -57.68 -23.28 50.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.343 -0.848 . . . . 0.0 109.822 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.93 -54.25 37.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.83 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.09 -18.87 64.82 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.289 -0.882 . . . . 0.0 110.03 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.436 ' CD1' ' HA ' ' A' ' 60' ' ' ALA . 59.6 mt -74.18 -15.6 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.266 -0.896 . . . . 0.0 110.295 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.73 -52.73 4.98 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.109 -0.994 . . . . 0.0 110.751 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.45 -56.34 23.21 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.195 -0.941 . . . . 0.0 110.226 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.414 ' CG ' ' OH ' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -52.59 -24.24 7.94 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.139 -0.976 . . . . 0.0 109.739 179.766 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.589 ' HA ' ' CD2' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -79.84 -16.56 55.2 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.358 -0.838 . . . . 0.0 110.049 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -71.31 -25.59 62.49 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.048 -1.032 . . . . 0.0 110.251 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -84.79 -38.28 19.77 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.085 -1.009 . . . . 0.0 110.413 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.589 ' CD2' ' HA ' ' A' ' 67' ' ' LEU . 7.8 m-30 -55.88 -19.84 13.4 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.451 -0.781 . . . . 0.0 110.344 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.47 -30.36 40.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.158 -0.964 . . . . 0.0 110.201 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.47 ' O ' ' CD2' ' A' ' 72' ' ' HIS . 34.5 p-80 -144.77 53.56 1.23 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.164 -0.96 . . . . 0.0 110.389 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.261 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.212 0.529 . . . . 0.0 110.157 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' A' ' 5' ' ' ALA . . . -54.17 -24.98 30.85 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -59.19 -57.81 11.42 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.22 -1.165 . . . . 0.0 110.048 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 59.8 t-105 -67.37 -10.96 56.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.291 -0.881 . . . . 0.0 110.485 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' A' ' 2' ' ' GLY . . . -70.1 -42.47 72.67 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.036 -1.04 . . . . 0.0 110.289 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -77.24 -32.3 55.63 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.223 -0.923 . . . . 0.0 110.332 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -64.87 -28.54 69.61 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.199 -0.938 . . . . 0.0 110.251 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -75.02 -33.39 61.78 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.192 -0.942 . . . . 0.0 110.153 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -70.74 -23.12 62.37 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.168 -0.957 . . . . 0.0 110.13 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.99 -44.63 30.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.214 -0.929 . . . . 0.0 110.184 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.632 ' O ' HG22 ' A' ' 14' ' ' ILE . 1.3 mm? -58.07 -30.17 66.01 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.055 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.76 -28.42 40.4 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.067 -1.021 . . . . 0.0 109.875 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.09 73.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.295 -0.878 . . . . 0.0 110.115 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 11' ' ' LEU . 65.7 mt -80.99 -10.63 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.27 -0.894 . . . . 0.0 110.344 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -31.59 56.6 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.848 -1.158 . . . . 0.0 110.755 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.5 m -85.27 -49.32 8.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.1 -1.0 . . . . 0.0 110.705 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -55.97 -49.45 73.53 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.211 -0.931 . . . . 0.0 110.307 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 1.069 HD13 ' CZ ' ' A' ' 31' ' ' PHE . 1.1 tp -69.93 -8.41 48.58 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.171 -0.956 . . . . 0.0 110.579 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -71.12 -20.24 62.35 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.966 -1.084 . . . . 0.0 109.399 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -97.65 -74.62 0.57 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.306 -0.872 . . . . 0.0 110.312 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.859 HD13 ' CG ' ' A' ' 70' ' ' TYR . 57.4 mt 61.43 12.78 4.57 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.289 -0.882 . . . . 0.0 110.831 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.82 -35.27 58.58 Favored Glycine 0 N--CA 1.483 1.805 0 N-CA-C 105.468 -3.053 . . . . 0.0 105.468 176.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.484 ' O ' ' N ' ' A' ' 25' ' ' GLU . . . -84.08 -36.29 13.41 Favored Glycine 0 N--CA 1.479 1.523 0 N-CA-C 107.088 -2.405 . . . . 0.0 107.088 177.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.721 ' HA ' HD23 ' A' ' 28' ' ' LEU . 87.9 p 47.07 -82.73 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.813 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 35.1 tt0 -37.93 -44.77 0.81 Allowed 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.696 -0.628 . . . . 0.0 112.183 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -95.63 -5.14 43.09 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.94 -1.1 . . . . 0.0 110.858 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 24' ' ' SER . 3.2 mm-40 -95.52 -73.8 0.58 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.158 -0.964 . . . . 0.0 111.322 -179.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.721 HD23 ' HA ' ' A' ' 24' ' ' SER . 0.5 OUTLIER -81.68 15.28 2.21 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.784 -1.197 . . . . 0.0 111.699 -178.912 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.813 ' HB2' ' O ' ' A' ' 25' ' ' GLU . . . -75.03 -47.27 29.82 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 176.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.37 -26.83 66.67 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 1.069 ' CZ ' HD13 ' A' ' 18' ' ' LEU . 0.3 OUTLIER -49.39 -55.46 12.94 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.403 -0.811 . . . . 0.0 109.593 178.508 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -49.81 -42.46 47.1 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.53 -0.731 . . . . 0.0 109.854 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.96 -18.0 62.66 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.856 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -69.76 0.58 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.245 -0.909 . . . . 0.0 110.419 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.415 ' O ' ' HB2' ' A' ' 38' ' ' PHE . 1.0 OUTLIER -43.14 -27.93 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.763 0 O-C-N 121.643 -0.66 . . . . 0.0 110.502 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.77 -47.29 75.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.891 -1.131 . . . . 0.0 109.12 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -75.66 -2.92 31.71 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.407 -0.808 . . . . 0.0 110.193 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.865 ' O ' HD13 ' A' ' 42' ' ' LEU . 0.7 OUTLIER -80.05 -22.21 42.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.053 -1.029 . . . . 0.0 109.926 179.822 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -92.09 -52.17 4.83 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.227 -0.92 . . . . 0.0 109.791 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.0 m -59.36 -30.12 68.17 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.292 -0.88 . . . . 0.0 110.283 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.407 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 1.2 tt0 -88.04 -33.38 18.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.186 -0.946 . . . . 0.0 110.446 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.865 HD13 ' O ' ' A' ' 38' ' ' PHE . 1.2 tp -46.12 -31.68 2.5 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.37 -0.831 . . . . 0.0 110.938 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.12 -29.26 14.66 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.126 -0.984 . . . . 0.0 110.273 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -95.71 8.2 44.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.308 -0.87 . . . . 0.0 111.304 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.407 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 1.2 p90 -78.94 -15.79 57.84 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.855 -1.153 . . . . 0.0 110.679 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.89 -158.87 0.73 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.17 -0.956 . . . . 0.0 108.856 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.451 ' O ' ' HB3' ' A' ' 48' ' ' LYS . . . -53.99 -49.75 57.72 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 108.003 -2.039 . . . . 0.0 108.003 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.451 ' HB3' ' O ' ' A' ' 47' ' ' GLY . 0.7 OUTLIER 169.73 54.26 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.827 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.765 ' O ' HG12 ' A' ' 53' ' ' VAL . . . -59.91 92.2 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.475 ' N ' ' CD ' ' A' ' 51' ' ' PRO . 3.8 m-80 -87.15 -49.03 0.47 Allowed Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.326 -1.102 . . . . 0.0 110.509 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.515 ' HA ' ' HB2' ' A' ' 54' ' ' GLU . 49.5 Cg_endo -80.31 -42.62 0.14 Allowed 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.504 1.265 . . . . 0.0 109.753 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -52.35 -66.14 0.44 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.439 -0.788 . . . . 0.0 110.36 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.765 HG12 ' O ' ' A' ' 49' ' ' GLY . 4.7 p -72.71 -7.24 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.01 -1.056 . . . . 0.0 110.506 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.515 ' HB2' ' HA ' ' A' ' 51' ' ' PRO . 2.1 tt0 -51.31 -47.97 62.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.958 -1.089 . . . . 0.0 109.849 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.86 -33.77 51.34 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.332 -0.855 . . . . 0.0 109.647 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.01 -4.54 35.95 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.38 -0.825 . . . . 0.0 110.353 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.8 ttt85 -87.27 -23.81 24.57 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.989 -1.069 . . . . 0.0 109.499 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.24 -39.59 15.29 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.796 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -70.9 -48.57 52.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.327 -0.858 . . . . 0.0 109.882 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.846 ' HA ' HD12 ' A' ' 63' ' ' ILE . . . -57.68 -23.28 50.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.343 -0.848 . . . . 0.0 109.822 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.93 -54.25 37.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.83 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.09 -18.87 64.82 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.289 -0.882 . . . . 0.0 110.03 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 60' ' ' ALA . 59.6 mt -74.18 -15.6 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.266 -0.896 . . . . 0.0 110.295 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.663 ' HA ' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -88.73 -52.73 4.98 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.109 -0.994 . . . . 0.0 110.751 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.406 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 1.4 m-20 -59.45 -56.34 23.21 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.195 -0.941 . . . . 0.0 110.226 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.414 ' CG ' ' OH ' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -52.59 -24.24 7.94 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.139 -0.976 . . . . 0.0 109.739 179.766 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.871 HD12 ' O ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER -79.84 -16.56 55.2 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.358 -0.838 . . . . 0.0 110.049 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 65' ' ' ASP . 0.5 OUTLIER -71.31 -25.59 62.49 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.048 -1.032 . . . . 0.0 110.251 179.55 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -84.79 -38.28 19.77 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.085 -1.009 . . . . 0.0 110.413 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.859 ' CG ' HD13 ' A' ' 21' ' ' LEU . 7.8 m-30 -55.88 -19.84 13.4 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.451 -0.781 . . . . 0.0 110.344 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.47 -30.36 40.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.158 -0.964 . . . . 0.0 110.201 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 30.4 p80 -144.77 53.56 1.23 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.164 -0.96 . . . . 0.0 110.389 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.453 ' HB2' ' HA ' ' A' ' 70' ' ' TYR . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.261 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.212 0.529 . . . . 0.0 110.157 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' A' ' 5' ' ' ALA . . . -54.17 -24.98 30.85 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -59.19 -57.81 11.42 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.22 -1.165 . . . . 0.0 110.048 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 59.8 t-105 -67.37 -10.96 56.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.291 -0.881 . . . . 0.0 110.485 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' A' ' 2' ' ' GLY . . . -70.1 -42.47 72.67 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.036 -1.04 . . . . 0.0 110.289 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -77.24 -32.3 55.63 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.223 -0.923 . . . . 0.0 110.332 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -64.87 -28.54 69.61 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.199 -0.938 . . . . 0.0 110.251 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -75.02 -33.39 61.78 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.192 -0.942 . . . . 0.0 110.153 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -70.74 -23.12 62.37 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.168 -0.957 . . . . 0.0 110.13 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.99 -44.63 30.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.214 -0.929 . . . . 0.0 110.184 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.632 ' O ' HG22 ' A' ' 14' ' ' ILE . 1.3 mm? -58.07 -30.17 66.01 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.055 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.76 -28.42 40.4 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.067 -1.021 . . . . 0.0 109.875 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.09 73.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.295 -0.878 . . . . 0.0 110.115 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 11' ' ' LEU . 65.7 mt -80.99 -10.63 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.27 -0.894 . . . . 0.0 110.344 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -31.59 56.6 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.848 -1.158 . . . . 0.0 110.755 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.5 m -85.27 -49.32 8.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.1 -1.0 . . . . 0.0 110.705 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -55.97 -49.45 73.53 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.211 -0.931 . . . . 0.0 110.307 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 1.069 HD13 ' CZ ' ' A' ' 31' ' ' PHE . 1.1 tp -69.93 -8.41 48.58 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.171 -0.956 . . . . 0.0 110.579 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -71.12 -20.24 62.35 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.966 -1.084 . . . . 0.0 109.399 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -97.65 -74.62 0.57 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.306 -0.872 . . . . 0.0 110.312 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.859 HD13 ' CG ' ' A' ' 70' ' ' TYR . 57.4 mt 61.43 12.78 4.57 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.289 -0.882 . . . . 0.0 110.831 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.82 -35.27 58.58 Favored Glycine 0 N--CA 1.483 1.805 0 N-CA-C 105.468 -3.053 . . . . 0.0 105.468 176.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.484 ' O ' ' N ' ' A' ' 25' ' ' GLU . . . -84.08 -36.29 13.41 Favored Glycine 0 N--CA 1.479 1.523 0 N-CA-C 107.088 -2.405 . . . . 0.0 107.088 177.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.721 ' HA ' HD23 ' A' ' 28' ' ' LEU . 87.9 p 47.07 -82.73 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.813 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 35.1 tt0 -37.93 -44.77 0.81 Allowed 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.696 -0.628 . . . . 0.0 112.183 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -95.63 -5.14 43.09 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.94 -1.1 . . . . 0.0 110.858 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 24' ' ' SER . 3.2 mm-40 -95.52 -73.8 0.58 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.158 -0.964 . . . . 0.0 111.322 -179.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.721 HD23 ' HA ' ' A' ' 24' ' ' SER . 0.5 OUTLIER -81.68 15.28 2.21 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.784 -1.197 . . . . 0.0 111.699 -178.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.813 ' HB2' ' O ' ' A' ' 25' ' ' GLU . . . -75.03 -47.27 29.82 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 176.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.37 -26.83 66.67 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 177.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 1.069 ' CZ ' HD13 ' A' ' 18' ' ' LEU . 0.3 OUTLIER -49.39 -55.46 12.94 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.403 -0.811 . . . . 0.0 109.593 178.508 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -49.81 -42.46 47.1 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.53 -0.731 . . . . 0.0 109.854 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.96 -18.0 62.66 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.856 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -69.76 0.58 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.245 -0.909 . . . . 0.0 110.419 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.415 ' O ' ' HB2' ' A' ' 38' ' ' PHE . 1.0 OUTLIER -43.14 -27.93 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.763 0 O-C-N 121.643 -0.66 . . . . 0.0 110.502 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.77 -47.29 75.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.891 -1.131 . . . . 0.0 109.12 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -75.66 -2.92 31.71 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.407 -0.808 . . . . 0.0 110.193 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.865 ' O ' HD13 ' A' ' 42' ' ' LEU . 0.7 OUTLIER -80.05 -22.21 42.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.053 -1.029 . . . . 0.0 109.926 179.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -92.09 -52.17 4.83 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.227 -0.92 . . . . 0.0 109.791 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.0 m -59.36 -30.12 68.17 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.292 -0.88 . . . . 0.0 110.283 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.407 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 1.2 tt0 -88.04 -33.38 18.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.186 -0.946 . . . . 0.0 110.446 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.865 HD13 ' O ' ' A' ' 38' ' ' PHE . 1.2 tp -46.12 -31.68 2.5 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.37 -0.831 . . . . 0.0 110.938 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.12 -29.26 14.66 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.126 -0.984 . . . . 0.0 110.273 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -95.71 8.2 44.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.308 -0.87 . . . . 0.0 111.304 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.407 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 1.2 p90 -78.94 -15.79 57.84 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.855 -1.153 . . . . 0.0 110.679 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.89 -158.87 0.73 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.17 -0.956 . . . . 0.0 108.856 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.451 ' O ' ' HB3' ' A' ' 48' ' ' LYS . . . -53.99 -49.75 57.72 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 108.003 -2.039 . . . . 0.0 108.003 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.451 ' HB3' ' O ' ' A' ' 47' ' ' GLY . 0.7 OUTLIER 169.73 54.26 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.827 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.765 ' O ' HG12 ' A' ' 53' ' ' VAL . . . -59.91 92.2 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.475 ' N ' ' CD ' ' A' ' 51' ' ' PRO . 3.8 m-80 -87.15 -49.03 0.47 Allowed Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.326 -1.102 . . . . 0.0 110.509 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.515 ' HA ' ' HB2' ' A' ' 54' ' ' GLU . 49.5 Cg_endo -80.31 -42.62 0.14 Allowed 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.504 1.265 . . . . 0.0 109.753 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -52.35 -66.14 0.44 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.439 -0.788 . . . . 0.0 110.36 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.765 HG12 ' O ' ' A' ' 49' ' ' GLY . 4.7 p -72.71 -7.24 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.01 -1.056 . . . . 0.0 110.506 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.515 ' HB2' ' HA ' ' A' ' 51' ' ' PRO . 2.1 tt0 -51.31 -47.97 62.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.958 -1.089 . . . . 0.0 109.849 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.86 -33.77 51.34 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.332 -0.855 . . . . 0.0 109.647 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.01 -4.54 35.95 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.38 -0.825 . . . . 0.0 110.353 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.8 ttt85 -87.27 -23.81 24.57 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.989 -1.069 . . . . 0.0 109.499 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.24 -39.59 15.29 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.796 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -70.9 -48.57 52.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.327 -0.858 . . . . 0.0 109.882 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.846 ' HA ' HD12 ' A' ' 63' ' ' ILE . . . -57.68 -23.28 50.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.343 -0.848 . . . . 0.0 109.822 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.93 -54.25 37.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.83 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.09 -18.87 64.82 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.289 -0.882 . . . . 0.0 110.03 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 60' ' ' ALA . 59.6 mt -74.18 -15.6 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.266 -0.896 . . . . 0.0 110.295 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.663 ' HA ' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -88.73 -52.73 4.98 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.109 -0.994 . . . . 0.0 110.751 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.406 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 1.4 m-20 -59.45 -56.34 23.21 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.195 -0.941 . . . . 0.0 110.226 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.414 ' CG ' ' OH ' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -52.59 -24.24 7.94 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.139 -0.976 . . . . 0.0 109.739 179.766 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.871 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -79.84 -16.56 55.2 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.358 -0.838 . . . . 0.0 110.049 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 65' ' ' ASP . 0.5 OUTLIER -71.31 -25.59 62.49 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.048 -1.032 . . . . 0.0 110.251 179.55 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -84.79 -38.28 19.77 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.085 -1.009 . . . . 0.0 110.413 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.859 ' CG ' HD13 ' A' ' 21' ' ' LEU . 7.8 m-30 -55.88 -19.84 13.4 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.451 -0.781 . . . . 0.0 110.344 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.47 -30.36 40.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.158 -0.964 . . . . 0.0 110.201 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.47 ' O ' ' CD2' ' A' ' 72' ' ' HIS . 34.5 p-80 -144.77 53.56 1.23 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.164 -0.96 . . . . 0.0 110.389 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.453 ' HB2' ' HA ' ' A' ' 70' ' ' TYR . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.261 179.957 . . . . . . . . 2 2 . 1 stop_ save_