data_5gow_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 5gow _Structure_validation_residue.Date_analyzed 2016-12-02 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 ' 399' ' ' GLU . . . . . 0.96 ' HG3' ' HE2' ' B' ' 62' ' ' LYS . 0.5 OUTLIER . . . . . 0 CA--C 1.51 -0.567 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -138.44 84.46 2.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.203 -178.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.561 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -139.09 -49.49 0.51 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.234 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -71.29 11.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.602 0.715 . . . . 0.0 110.177 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.679 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -54.76 114.12 1.59 Allowed 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.186 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 . . . . . 0 C--N 1.317 -0.835 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.268 -177.88 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 99.0 t . . . . . 0 N--CA 1.452 -0.356 0 CA-C-O 121.19 0.519 . . . . 0.0 111.471 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.5 mt -95.57 -29.51 14.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.498 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.657 HD21 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.07 123.91 26.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.749 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.433 HG22 ' CE1' ' B' ' 25' ' ' TYR . 55.5 mt -108.95 122.65 63.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.826 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.9 t -115.07 150.05 17.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.604 ' O ' HG22 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.66 177.25 4.74 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.064 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.566 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.15 75.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 125.555 1.784 . . . . 0.0 112.971 -178.654 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.604 HG22 ' O ' ' B' ' 13' ' ' LYS . 25.1 t -123.82 119.7 57.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.1 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.58 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 30.8 mtp180 -89.42 128.42 35.94 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.858 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -126.9 104.33 7.97 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.685 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.22 50.88 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.771 179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.26 26.13 10.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.752 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.515 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.1 tt0 -138.31 121.59 17.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.776 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.417 ' HA ' ' HA ' ' B' ' 16' ' ' ARG . 2.1 t70 -76.94 154.0 34.06 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.894 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -178.27 -156.12 15.97 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.218 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 133.57 48.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.921 HD13 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.47 142.19 29.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.516 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . 0.433 ' CE1' HG22 ' B' ' 11' ' ' ILE . 50.3 m-85 -137.72 110.59 7.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.913 HD13 HG12 ' B' ' 92' ' ' VAL . 9.3 mt -87.97 128.45 35.38 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 12.5 mtt -108.24 166.6 10.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.63 -47.91 14.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -117.11 3.68 12.71 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -156.11 153.24 29.02 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.624 -0.83 . . . . 0.0 112.515 -177.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.978 HD11 HD12 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.78 121.43 52.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.09 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.487 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.08 153.74 37.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.913 0.387 . . . . 0.0 110.783 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.921 ' HB2' HD13 ' B' ' 24' ' ' LEU . 45.6 t90 -147.26 134.17 20.21 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.475 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -111.98 127.41 26.9 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.714 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.491 ' HG2' ' HB2' ' B' ' 38' ' ' LYS . 58.9 Cg_endo -75.05 142.69 28.0 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.461 2.107 . . . . 0.0 111.801 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -58.77 133.6 56.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.721 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.11 -5.81 75.66 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.398 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.491 ' HB2' ' HG2' ' B' ' 35' ' ' PRO . 1.7 mppt? -113.39 153.55 28.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -98.04 -11.94 22.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.3 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -118.66 152.9 35.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.081 0.467 . . . . 0.0 112.002 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.475 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 21.7 m-85 -81.19 122.8 27.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.6 p -91.58 -8.72 46.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.269 0.557 . . . . 0.0 110.328 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.672 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 15.2 mm -117.08 119.54 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.189 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.3 t -148.0 101.52 3.3 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.462 ' CD2' HG21 ' B' ' 43' ' ' ILE . 73.8 m-70 -124.87 137.72 54.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.004 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.482 ' HB2' ' OD2' ' B' ' 49' ' ' ASP . 21.6 mmm -86.53 140.27 30.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.643 ' HB3' HD21 ' B' ' 100' ' ' LEU . 21.7 m-85 -57.56 -23.08 48.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.846 0.355 . . . . 0.0 110.544 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.13 -20.48 61.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.968 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.605 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -98.55 -8.89 25.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.087 0.47 . . . . 0.0 110.318 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.651 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.7 mm -87.43 127.66 40.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 7.6 tttp -88.44 -46.67 8.95 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.548 0.689 . . . . 0.0 109.727 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.657 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.8 p -154.48 -177.9 6.78 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.145 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . 0.582 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 10.3 pt20 -144.18 143.34 31.04 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.717 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.009 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 25.7 mttp -113.08 153.04 28.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.513 HD12 ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -130.06 127.04 62.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 176.202 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' SER . . . . . 0.526 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -87.51 120.0 70.95 Favored Pre-proline 0 C--O 1.249 1.041 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.51 172.94 12.41 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 124.864 3.709 . . . . 0.0 113.928 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -61.76 160.3 12.06 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.888 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.01 8.1 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.619 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 5.2 mttp -85.11 162.96 19.06 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.26 -5.85 46.76 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.308 0.575 . . . . 0.0 110.478 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.96 ' HE2' ' HG3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -146.86 157.73 43.73 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.373 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.607 HG22 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -96.64 134.44 34.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.54 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 24.0 mt-30 -135.5 163.24 30.52 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.58 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -141.83 153.22 44.34 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 113.547 -1.66 . . . . 0.0 107.377 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.009 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -146.54 139.68 25.58 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 119.052 0.842 . . . . 0.0 111.256 178.742 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.978 HD12 HD11 ' B' ' 31' ' ' ILE . 96.2 mt -94.23 104.58 16.58 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.77 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.657 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.5 t -91.36 111.71 24.28 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.463 HD23 HD12 ' B' ' 50' ' ' ILE . 5.2 mt -94.23 157.57 15.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.605 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -79.02 -4.77 51.73 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.423 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.8 -5.61 53.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.636 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.6 20.69 50.45 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . 0.403 ' HB3' HD11 ' B' ' 69' ' ' LEU . 20.9 t70 -125.91 158.78 34.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.354 -0.423 . . . . 0.0 110.415 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.53 HG23 ' HA ' ' B' ' 68' ' ' VAL . 16.1 p -137.5 131.14 31.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.836 0.351 . . . . 0.0 110.316 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.546 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.13 101.09 10.6 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.062 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.51 137.92 32.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.207 0.527 . . . . 0.0 111.719 -178.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.672 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 53.2 m-85 -122.77 111.46 16.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.899 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.58 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.8 t-160 -88.43 104.14 16.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.132 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.615 ' HZ ' HG23 ' B' ' 92' ' ' VAL . 58.4 m-85 -75.09 100.22 4.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.14 -2.02 47.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.566 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.2 t-20 -79.78 91.29 5.31 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.27 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.86 -37.77 9.32 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 52.4 m -53.85 -59.42 4.65 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.538 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.6 p -127.57 9.94 6.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -176.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.555 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.41 -48.9 7.17 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.545 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.1 -51.87 67.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.983 0.421 . . . . 0.0 110.87 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.538 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 7.6 mttt -67.48 -34.92 78.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.053 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.644 ' O ' HG21 ' B' ' 92' ' ' VAL . 11.9 mt-10 -64.64 -46.86 80.73 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.607 ' HD3' HG22 ' B' ' 63' ' ' ILE . 25.3 ttp180 -53.83 -47.73 70.63 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.88 -46.47 87.7 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.6 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.08 -42.39 89.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 118.137 0.426 . . . . 0.0 111.164 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.913 HG12 HD13 ' B' ' 26' ' ' LEU . 47.9 t -60.95 -43.87 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.582 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.3 ttpm? -59.52 -55.21 37.49 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.843 178.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.75 -54.12 42.65 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.908 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.633 ' HG ' HD11 ' B' ' 99' ' ' LEU . 13.5 tp -61.99 -38.36 88.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.807 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 24.7 mt -70.58 -43.31 69.66 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' B' ' 93' ' ' LYS . 37.3 mt-30 -63.69 -21.13 66.23 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 122.158 0.98 . . . . 0.0 109.051 178.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -84.15 -50.59 7.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.159 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.633 HD11 ' HG ' ' B' ' 95' ' ' LEU . 17.4 mt -78.62 -46.68 18.71 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -176.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.651 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.2 mt -49.86 -60.07 5.74 Favored Pre-proline 0 N--CA 1.468 0.443 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -176.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.87 -13.88 37.46 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.17 1.913 . . . . 0.0 113.828 -178.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 18.9 mtmm -87.78 -6.34 58.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.433 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 . . . . . 0 C--N 1.327 -0.379 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.802 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.949 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.8 tt0 . . . . . 0 CA--C 1.508 -0.657 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.43 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -132.24 93.09 3.2 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.535 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.9 p-10 -138.42 -45.34 0.5 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.618 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -74.12 13.37 0.56 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.723 0.773 . . . . 0.0 110.645 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.98 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.52 123.93 17.89 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.547 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.773 -179.332 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 80.2 t . . . . . 0 CA--C 1.518 -0.252 0 CA-C-O 121.053 0.454 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.447 ' HB2' HD21 ' B' ' 95' ' ' LEU . 48.5 mt -94.94 -29.06 14.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.393 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 5.7 tp -142.61 138.32 30.66 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.8 mt -121.57 121.59 64.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.692 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.1 t -112.06 149.21 14.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.819 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.533 ' O ' HG22 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.71 178.16 4.56 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.977 -179.63 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.517 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 12.7 mtpt 17.94 74.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 O-C-N 125.344 1.653 . . . . 0.0 113.727 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.533 HG22 ' O ' ' B' ' 13' ' ' LYS . 50.2 t -119.28 121.61 66.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.773 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.597 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 95.6 mtt180 -89.26 135.73 33.42 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.193 0.521 . . . . 0.0 111.464 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -130.57 106.53 8.56 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.626 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.5 OUTLIER 63.49 49.97 2.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.033 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.418 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.7 OUTLIER 70.7 25.6 4.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.205 178.754 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.522 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.8 tt0 -134.96 119.5 18.07 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.089 -0.244 . . . . 0.0 111.212 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.64 153.31 43.62 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.47 -157.95 19.51 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.314 -0.469 . . . . 0.0 112.474 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -129.33 132.18 47.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.833 0.349 . . . . 0.0 110.334 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.884 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -97.43 130.95 44.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.029 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -124.05 128.43 49.33 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.888 HD11 HG12 ' B' ' 92' ' ' VAL . 22.2 mt -108.47 118.01 35.67 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -98.65 165.22 11.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.026 179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.8 -50.65 44.11 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.309 -0.86 . . . . 0.0 113.226 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -104.49 -3.75 23.57 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 167.2 30.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 119.421 -0.912 . . . . 0.0 112.704 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.804 HD13 HD11 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -115.9 125.66 73.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.65 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -129.92 119.02 22.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.236 0.541 . . . . 0.0 111.424 -178.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.884 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.8 t90 -112.05 133.82 53.98 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.002 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.479 ' HB3' ' CD2' ' B' ' 41' ' ' PHE . . . -115.67 135.28 22.64 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.231 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.804 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -74.1 150.84 43.52 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.576 2.184 . . . . 0.0 111.617 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -61.32 133.22 55.62 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.182 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.91 8.92 86.06 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.805 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.804 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.37 146.58 39.23 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.45 -0.441 . . . . 0.0 110.505 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . 0.453 ' OD2' ' HD2' ' B' ' 40' ' ' ARG . 2.4 p-10 -94.99 0.39 54.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.473 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.453 ' HD2' ' OD2' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -136.39 151.65 49.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.104 0.478 . . . . 0.0 111.785 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.479 ' CD2' ' HB3' ' B' ' 34' ' ' ALA . 35.5 m-85 -82.24 121.77 27.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.393 -0.821 . . . . 0.0 108.94 178.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.2 p -86.5 -19.8 28.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.162 0.506 . . . . 0.0 110.3 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.786 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 49.5 mm -108.63 110.68 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.803 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 7.5 t -137.69 101.6 4.51 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -129.13 144.24 51.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.045 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.464 ' O ' HG12 ' B' ' 50' ' ' ILE . 76.6 mmm -88.58 143.94 26.63 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.705 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -61.82 -18.97 61.95 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.89 -15.02 60.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.506 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.623 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.69 -6.02 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 109.983 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.653 ' HB ' HD21 ' B' ' 100' ' ' LEU . 1.9 mm -90.42 129.23 41.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.45 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 11.2 ttpt -86.32 -33.44 20.6 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.24 0.543 . . . . 0.0 109.825 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.519 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 27.5 p -178.38 -178.16 0.6 Allowed 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.089 -0.96 . . . . 0.0 108.638 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . 0.456 ' OE1' HD13 ' B' ' 100' ' ' LEU . 5.4 pm0 -134.89 140.94 46.18 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.996 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.107 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 47.1 mttp -102.2 145.29 29.62 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.353 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.51 HD13 ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -124.15 129.39 74.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.099 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 176.677 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' SER . . . . . 0.492 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -90.17 117.52 68.12 Favored Pre-proline 0 C--O 1.251 1.138 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.59 173.03 10.49 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 125.165 3.91 . . . . 0.0 114.441 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.7 mp0 -61.12 160.48 10.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.069 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.76 -28.94 8.13 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.949 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.8 mttp -87.79 152.8 21.84 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.65 -20.34 66.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.228 0.537 . . . . 0.0 110.322 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.723 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.1 OUTLIER -135.48 144.0 46.15 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.923 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.644 HG21 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -85.44 142.36 13.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.516 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 21.0 mt-30 -141.01 163.51 32.78 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.404 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -141.96 153.46 44.34 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.039 -1.437 . . . . 0.0 108.04 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.107 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.71 146.03 30.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 119.045 0.839 . . . . 0.0 110.678 178.18 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.804 HD11 HD13 ' B' ' 31' ' ' ILE . 55.7 mt -97.19 106.65 19.01 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.149 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.586 ' HA ' HG21 ' B' ' 74' ' ' THR . 14.1 t -91.72 124.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.457 HD21 HD12 ' B' ' 50' ' ' ILE . 5.5 mt -108.08 153.91 22.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.022 0.439 . . . . 0.0 112.151 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.623 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -76.06 -5.48 46.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.768 0.794 . . . . 0.0 108.977 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.2 -4.64 48.67 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.6 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.26 20.68 51.77 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.465 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . 0.441 ' HB3' HD12 ' B' ' 69' ' ' LEU . 23.5 t70 -126.2 160.47 30.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.561 -0.32 . . . . 0.0 110.509 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.586 HG21 ' HA ' ' B' ' 68' ' ' VAL . 15.8 p -141.65 131.22 23.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.048 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 10.5 m -110.21 104.17 12.96 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.106 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -82.26 153.58 25.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.235 0.54 . . . . 0.0 112.206 -178.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.786 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 64.5 m-85 -140.02 111.31 7.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.857 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.597 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.78 112.01 21.29 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.772 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 20.6 m-85 -76.91 92.52 3.66 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.2 9.16 34.88 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.517 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 52.2 t30 -84.76 92.75 8.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.03 0.443 . . . . 0.0 110.238 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -49.85 -32.0 13.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.678 -178.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.99 -60.63 3.02 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -178.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.475 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.7 p -128.27 14.19 6.67 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.772 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.96 -46.02 10.85 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.413 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.56 -54.52 33.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.475 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -64.66 -37.64 88.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.229 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.718 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 14.2 mt-10 -65.5 -45.17 84.61 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.278 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.644 ' HD3' HG21 ' B' ' 63' ' ' ILE . 19.2 ttp180 -54.99 -47.02 75.18 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.03 -44.96 95.59 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 113.536 -1.665 . . . . 0.0 112.568 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.93 -42.09 81.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 117.841 0.291 . . . . 0.0 111.073 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.888 HG12 HD11 ' B' ' 26' ' ' LEU . 34.0 t -62.41 -42.21 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.17 -56.2 25.18 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.579 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.09 -52.59 63.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.087 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.776 ' HG ' HD12 ' B' ' 99' ' ' LEU . 15.1 tp -61.96 -42.54 99.24 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.038 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.537 HD13 HG13 ' B' ' 92' ' ' VAL . 19.1 mt -68.23 -43.47 77.88 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.73 -21.31 65.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.361 1.077 . . . . 0.0 109.347 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.42 -50.93 6.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.164 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.776 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.8 mt -74.28 -50.88 17.08 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 113.452 -1.704 . . . . 0.0 114.675 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.705 HD23 ' HB3' ' B' ' 47' ' ' TYR . 40.5 mt -49.87 -57.53 12.12 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.602 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 62.2 Cg_exo -54.84 -16.92 12.51 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.614 2.209 . . . . 0.0 114.076 -179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -87.52 -13.65 42.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.754 0.312 . . . . 0.0 110.945 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.793 -179.091 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.923 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.1 tt0 . . . . . 0 CA--C 1.515 -0.389 0 CA-C-O 120.89 0.376 . . . . 0.0 110.463 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.49 ' HB2' ' CD2' ' A' ' 403' ' ' PHE . 9.4 p-10 -135.64 92.1 2.79 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.351 0.596 . . . . 0.0 112.241 -177.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.534 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.3 p-10 -139.48 -46.99 0.46 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -73.14 11.56 0.7 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.786 0.803 . . . . 0.0 110.44 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.842 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -55.49 116.14 2.71 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.39 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.572 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 95.5 t . . . . . 0 CA--C 1.519 -0.247 0 CA-C-O 121.048 0.451 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.401 ' HB2' HD23 ' B' ' 95' ' ' LEU . 25.7 mt -97.53 -29.75 13.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.841 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.0 tp -139.5 140.4 37.2 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 79.4 mt -122.59 121.94 64.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.75 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.3 t -111.96 148.21 15.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.929 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.589 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.03 175.68 5.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.548 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.1 79.68 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 O-C-N 125.393 1.683 . . . . 0.0 113.61 -179.62 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.589 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.6 t -130.74 126.98 61.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 114.878 -1.056 . . . . 0.0 108.957 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.58 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 9.2 mtm180 -95.16 144.87 25.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.597 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.8 110.33 6.68 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 13.0 tppt? 67.82 52.19 0.74 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.627 0.727 . . . . 0.0 110.003 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 62.89 25.28 14.99 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.869 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.568 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.6 pt20 -138.32 131.72 30.49 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.98 -0.45 . . . . 0.0 110.263 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -82.72 153.52 25.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -177.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.11 -154.77 12.42 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.914 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 136.65 50.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.085 0.469 . . . . 0.0 110.077 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.912 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.44 141.79 30.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.938 -178.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 40.2 m-85 -133.19 122.54 24.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.846 HD11 HG13 ' B' ' 92' ' ' VAL . 19.6 mt -104.34 120.67 41.71 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.8 -178.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -100.99 161.61 13.47 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.19 -20.41 65.39 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -107.78 -20.2 13.29 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -161.9 167.67 24.28 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.824 -176.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.854 HD13 HD12 ' B' ' 67' ' ' LEU . 1.1 tt -109.65 117.71 55.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -119.05 152.65 36.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.969 0.414 . . . . 0.0 110.752 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.912 ' HB2' HD12 ' B' ' 24' ' ' LEU . 38.3 t90 -147.32 140.78 25.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -125.51 138.16 31.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.944 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -68.33 153.6 73.89 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.644 2.229 . . . . 0.0 111.374 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -65.23 116.01 6.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.964 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.96 4.1 54.48 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.432 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.544 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -97.36 143.22 28.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.582 0.706 . . . . 0.0 111.253 179.762 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . 0.422 ' CG ' ' HZ2' ' B' ' 38' ' ' LYS . 0.4 OUTLIER -83.63 -14.29 52.28 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.494 -179.533 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.42 156.81 45.23 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.939 0.399 . . . . 0.0 111.463 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -75.69 131.49 39.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.187 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -92.61 -28.93 16.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.442 0.639 . . . . 0.0 109.752 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.755 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 16.7 mm -97.57 123.84 50.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.404 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 31.2 t -147.99 101.45 3.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.472 ' CD2' HG21 ' B' ' 43' ' ' ILE . 85.0 m-70 -124.61 128.74 49.35 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.67 0.272 . . . . 0.0 110.816 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.522 ' O ' HG12 ' B' ' 50' ' ' ILE . 0.0 OUTLIER -78.96 139.72 38.17 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.869 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.564 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -58.84 -24.32 61.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.65 -8.74 57.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.57 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.577 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.9 OUTLIER -111.63 -10.14 14.12 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.282 0.563 . . . . 0.0 110.289 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.736 ' HB ' HD21 ' B' ' 100' ' ' LEU . 1.1 mm -91.94 130.2 41.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 11.1 tttp -89.78 -46.25 8.72 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.435 0.636 . . . . 0.0 110.08 -179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.53 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -155.95 -177.88 6.9 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.679 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -146.48 143.11 28.74 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.713 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.105 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 46.2 mttp -108.76 156.62 19.41 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.985 0.421 . . . . 0.0 110.123 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.502 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.9 OUTLIER -132.11 130.04 60.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 176.27 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' SER . . . . . 0.511 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.36 117.81 68.54 Favored Pre-proline 0 C--O 1.25 1.121 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.19 173.45 12.21 Favored 'Trans proline' 0 C--N 1.344 0.298 1 C-N-CA 125.357 4.038 . . . . 0.0 114.544 -177.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.68 160.56 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.09 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.85 -29.27 7.89 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.923 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.9 mttp -91.34 150.58 21.23 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.28 -4.24 21.03 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.134 0.492 . . . . 0.0 110.742 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.81 143.94 33.68 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.756 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.636 HG21 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -90.55 136.62 23.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.511 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 13.8 mt-30 -138.17 163.35 31.9 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -141.09 154.03 45.74 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.184 -1.371 . . . . 0.0 107.964 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.105 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.71 143.67 28.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 118.927 0.785 . . . . 0.0 111.21 178.368 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.854 HD12 HD13 ' B' ' 31' ' ' ILE . 77.4 mt -96.02 109.77 22.12 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.138 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.558 ' HA ' HG23 ' B' ' 74' ' ' THR . 4.7 t -95.41 108.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.499 HD23 HD13 ' B' ' 50' ' ' ILE . 4.1 mt -92.06 156.17 17.58 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.045 0.45 . . . . 0.0 112.008 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.577 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -80.18 1.13 29.44 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.347 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.49 -7.61 59.63 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.251 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.0 17.56 47.03 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.745 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.22 159.37 33.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.7 0.286 . . . . 0.0 110.711 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.575 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 20.8 p -135.35 130.86 35.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.885 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.532 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.18 102.42 11.56 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.367 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -82.22 142.72 31.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.465 0.65 . . . . 0.0 111.742 -178.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.755 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 52.2 m-85 -126.79 115.25 19.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.206 179.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.584 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 6.0 t60 -87.2 110.64 20.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.866 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.821 ' HB3' ' HB2' ' B' ' 85' ' ' ALA . 26.8 m-85 -81.56 93.23 6.66 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.1 4.02 52.86 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.548 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -81.79 91.27 6.47 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 121.212 0.53 . . . . 0.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.7 -39.95 5.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.423 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -59.64 4.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.467 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.1 p -127.61 10.43 6.64 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.821 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -44.47 -46.86 9.88 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.406 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.99 -53.88 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.84 0.352 . . . . 0.0 110.772 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.467 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 3.8 mttt -65.49 -35.89 82.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.057 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.753 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.5 mt-10 -65.37 -47.26 77.0 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.636 ' HD3' HG21 ' B' ' 63' ' ' ILE . 22.3 ttp180 -54.43 -47.57 72.66 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.015 0.912 . . . . 0.0 108.596 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.39 -45.73 91.8 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.662 -1.608 . . . . 0.0 112.357 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.14 -40.71 90.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.909 0.322 . . . . 0.0 110.998 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.846 HG13 HD11 ' B' ' 26' ' ' LEU . 40.9 t -62.92 -43.45 98.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 177.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.76 -55.38 35.88 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.588 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -53.46 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.463 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.852 ' HG ' HD11 ' B' ' 99' ' ' LEU . 12.7 tp -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.272 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.431 HD12 HG11 ' B' ' 92' ' ' VAL . 30.9 mt -71.01 -47.75 57.03 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 117.663 0.21 . . . . 0.0 110.981 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.41 -17.83 63.08 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.76 0.791 . . . . 0.0 109.757 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -88.3 -48.45 7.66 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.863 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.852 HD11 ' HG ' ' B' ' 95' ' ' LEU . 9.9 mt -79.29 -47.46 15.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.087 -1.415 . . . . 0.0 114.538 -177.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.736 HD21 ' HB ' ' B' ' 50' ' ' ILE . 26.5 mt -49.81 -53.88 37.74 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 17.4 Cg_endo -57.45 -18.52 31.94 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.332 2.021 . . . . 0.0 113.4 -179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -87.58 -8.52 56.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.715 0.293 . . . . 0.0 111.292 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.328 -179.883 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.64 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.508 -0.671 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.435 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 3.9 m-20 -139.83 87.48 2.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.547 ' C ' ' H ' ' A' ' 403' ' ' PHE . 1.3 p30 -138.45 -48.62 0.53 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -67.98 6.89 0.62 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.636 0.732 . . . . 0.0 110.637 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.893 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.56 120.3 7.52 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.766 179.107 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.78 -178.677 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.491 HG21 ' HE1' ' B' ' 27' ' ' MET . 96.3 t . . . . . 0 CA--C 1.514 -0.425 0 CA-C-O 121.199 0.523 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 34.7 mt -91.37 -33.3 15.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.181 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tp -131.21 127.48 37.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.992 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 71.1 mt -110.21 124.25 66.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.842 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.4 t -115.65 150.24 17.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.331 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.597 ' O ' HG21 ' B' ' 15' ' ' VAL . 1.5 mtmp? -115.47 178.0 4.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.3 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.571 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.44 70.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 O-C-N 125.294 1.621 . . . . 0.0 113.245 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.597 HG21 ' O ' ' B' ' 13' ' ' LYS . 19.7 t -119.1 131.26 72.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.022 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.694 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 98.9 mtt180 -101.96 139.2 37.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.316 0.579 . . . . 0.0 111.301 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.554 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -134.84 109.57 8.61 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.968 -1.014 . . . . 0.0 108.728 179.039 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.95 41.43 6.58 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.477 0.485 . . . . 0.0 110.914 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.1 tptp 73.95 27.3 1.65 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.548 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.694 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 35.8 mt-30 -125.82 124.24 40.49 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -85.78 139.36 31.38 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.013 0.196 . . . . 0.0 110.798 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.518 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -172.96 -153.71 9.74 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.51 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.29 137.85 52.93 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.911 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.61 142.28 33.21 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.736 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -136.44 120.68 17.9 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.84 HD12 HG11 ' B' ' 92' ' ' VAL . 15.2 mt -100.27 120.66 40.26 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.636 -0.425 . . . . 0.0 111.28 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.491 ' HE1' HG21 ' B' ' 8' ' ' VAL . 2.6 mpt? -96.51 166.91 11.46 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.12 66.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -116.62 -0.89 12.28 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . 0.446 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 16.8 ptt180 -157.13 158.69 36.81 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 119.158 -1.017 . . . . 0.0 112.699 -177.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.974 HD12 HD12 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -110.39 121.62 63.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.73 178.658 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.423 ' HB1' ' HE3' ' B' ' 27' ' ' MET . . . -122.85 150.43 42.88 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.038 0.447 . . . . 0.0 110.662 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.911 ' HB2' HD11 ' B' ' 24' ' ' LEU . 31.1 t90 -146.99 139.83 25.1 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.419 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -131.1 137.52 30.88 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.518 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 22.1 Cg_exo -64.52 160.93 37.27 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.515 2.143 . . . . 0.0 111.515 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.44 131.26 50.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.191 0.519 . . . . 0.0 111.358 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.01 29.85 68.51 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.078 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.426 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 21.8 mmtm -113.7 147.55 37.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 117.023 0.412 . . . . 0.0 110.46 179.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -96.32 -14.65 22.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.044 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -124.02 146.7 48.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.45 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -83.57 121.83 27.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.818 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.1 p -83.81 -21.13 32.2 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.262 0.553 . . . . 0.0 110.411 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.783 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 10.3 mm -106.28 124.39 61.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.56 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 42.3 t -147.78 101.45 3.32 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.827 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.509 ' CD2' HG21 ' B' ' 43' ' ' ILE . 73.4 m-70 -129.94 139.13 51.15 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.515 ' O ' HG12 ' B' ' 50' ' ' ILE . 79.6 mmm -92.4 142.77 27.06 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.726 ' HB3' HD21 ' B' ' 100' ' ' LEU . 21.7 m-85 -59.18 -21.3 59.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.25 0.548 . . . . 0.0 109.817 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . 0.613 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -68.38 -22.75 64.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.144 -0.935 . . . . 0.0 112.185 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.57 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -102.54 -10.92 18.91 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.999 0.428 . . . . 0.0 110.771 -179.426 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.704 ' HB ' HD22 ' B' ' 100' ' ' LEU . 0.9 OUTLIER -86.35 132.45 32.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.678 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -92.72 -55.34 3.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.609 0.719 . . . . 0.0 109.964 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.485 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -144.52 -177.45 5.5 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . 0.637 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 6.3 pt20 -141.87 145.85 35.1 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.694 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.047 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 49.3 mttp -107.16 147.05 30.59 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 177.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.665 ' HB ' ' HD3' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.92 123.46 62.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 176.365 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -88.97 120.27 69.94 Favored Pre-proline 0 C--O 1.245 0.868 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -69.53 172.69 11.96 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 124.415 3.41 . . . . 0.0 113.968 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.46 161.29 12.04 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.203 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.85 -28.96 7.75 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.64 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 6.4 mttp -85.24 161.36 19.6 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 175.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.02 -16.75 64.18 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.357 0.599 . . . . 0.0 110.496 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.502 ' HE2' ' HG3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -140.05 150.37 44.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.415 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.6 ' O ' ' HB2' ' B' ' 79' ' ' PHE . 4.1 mp -89.11 135.09 26.73 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.421 HE21 ' HB2' ' B' ' 64' ' ' GLN . 7.0 mt-30 -134.35 162.95 30.79 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -175.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.737 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -140.0 153.62 46.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.968 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.047 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.45 145.51 30.24 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 119.232 0.924 . . . . 0.0 110.72 178.26 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.974 HD12 HD12 ' B' ' 31' ' ' ILE . 95.6 mt -94.74 109.08 21.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.421 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.489 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.0 t -95.36 108.72 21.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.536 HD22 HD11 ' B' ' 50' ' ' ILE . 5.2 mt -88.77 155.83 19.33 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.102 -177.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.57 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -79.23 -1.58 37.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.666 0.746 . . . . 0.0 109.034 178.294 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -5.91 58.71 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.584 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.5 20.45 44.65 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.556 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . 0.521 ' HB3' HD11 ' B' ' 69' ' ' LEU . 19.1 t70 -126.14 160.86 29.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.62 -0.29 . . . . 0.0 110.279 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.527 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 17.5 p -138.23 131.21 29.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.459 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.53 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.8 m -110.46 102.77 11.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -82.99 144.63 29.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.552 0.691 . . . . 0.0 112.303 -177.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.783 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 46.5 m-85 -129.59 107.32 9.36 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.564 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.564 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.98 112.43 21.82 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.639 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.737 ' HE1' ' HB2' ' B' ' 65' ' ' LEU . 81.3 m-85 -83.56 95.98 8.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.92 5.47 51.56 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.571 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.4 t-20 -87.23 91.45 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.915 0.388 . . . . 0.0 110.015 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.06 -39.28 9.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.923 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.91 -59.44 4.33 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.507 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.61 10.41 6.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.505 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -44.99 -48.5 11.47 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.246 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.587 HG22 HG12 ' B' ' 63' ' ' ILE . 4.8 t -57.63 -52.14 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.15 0.5 . . . . 0.0 110.685 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.507 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.6 mttt -68.72 -33.63 74.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.595 ' HB3' ' CE2' ' B' ' 79' ' ' PHE . 11.3 mt-10 -65.79 -43.53 88.49 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.665 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 6.1 ttm105 -57.73 -43.71 85.51 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 177.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.22 -44.76 87.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.289 -1.323 . . . . 0.0 112.758 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.06 -45.11 74.77 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 117.784 0.266 . . . . 0.0 111.451 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.84 HG11 HD12 ' B' ' 26' ' ' LEU . 44.4 t -60.69 -43.19 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.637 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.4 ttpm? -59.27 -55.01 40.33 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.821 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -53.84 -54.33 39.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.474 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.659 ' HG ' HD13 ' B' ' 99' ' ' LEU . 12.2 tp -61.76 -41.71 98.05 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.349 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.514 HD12 HG12 ' B' ' 92' ' ' VAL . 22.1 mt -69.29 -44.62 71.42 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 117.876 0.307 . . . . 0.0 110.221 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . 0.467 ' N ' HE22 ' B' ' 53' ' ' GLN . 5.8 tp-100 -62.0 -24.28 66.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.233 1.016 . . . . 0.0 109.079 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.461 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 2.0 mm-40 -84.97 -44.76 12.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.299 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.665 HD12 ' CE2' ' B' ' 47' ' ' TYR . 20.4 mt -81.06 -47.07 14.05 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.726 HD21 ' HB3' ' B' ' 47' ' ' TYR . 34.6 mt -50.15 -56.77 15.64 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -176.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.564 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 52.4 Cg_exo -57.09 -22.32 46.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.407 2.071 . . . . 0.0 114.094 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' B' ' 98' ' ' GLN . 12.2 mtpt -88.53 -10.93 47.2 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.613 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 71.4 m-85 . . . . . 0 C--N 1.329 -0.29 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.677 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.902 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.51 -0.582 0 CA-C-O 120.513 0.197 . . . . 0.0 111.316 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 177.7 77.12 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.052 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.578 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.04 -54.2 0.58 Allowed 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -177.621 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . 0.403 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 3.9 p30 -69.9 11.5 0.29 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.728 0.775 . . . . 0.0 110.555 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.964 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.53 126.28 25.85 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.858 179.352 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.714 -178.865 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.605 HG21 ' HE1' ' B' ' 27' ' ' MET . 49.0 t . . . . . 0 N--CA 1.45 -0.442 0 CA-C-O 121.08 0.466 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.1 mt -97.37 -30.39 12.96 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.476 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 8.5 tp -131.76 127.31 36.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.837 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.413 HG23 ' CE1' ' B' ' 25' ' ' TYR . 75.8 mt -111.78 121.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.814 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -111.21 149.9 13.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.215 -179.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.577 ' O ' HG22 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.65 176.94 4.86 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.841 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.541 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.0 mtpm? 18.17 72.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 O-C-N 125.352 1.657 . . . . 0.0 113.527 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.577 HG22 ' O ' ' B' ' 13' ' ' LYS . 18.6 t -119.83 124.52 72.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.577 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.568 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 4.8 mtp180 -89.19 120.21 30.37 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.179 0.514 . . . . 0.0 111.252 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.617 ' HG2' HG13 ' B' ' 43' ' ' ILE . 28.1 tp60 -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.21 37.57 2.08 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.24 23.81 7.68 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.336 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.534 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.2 tt0 -126.21 120.77 30.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.326 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.57 153.29 43.03 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.758 0.313 . . . . 0.0 111.808 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.413 ' HA2' ' N ' ' B' ' 36' ' ' GLU . . . 178.08 -154.9 15.83 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.783 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.98 132.87 49.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.997 0.427 . . . . 0.0 110.387 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.827 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -99.01 143.13 29.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.54 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . 0.413 ' CE1' HG23 ' B' ' 11' ' ' ILE . 66.5 m-85 -134.28 124.42 25.85 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.938 HD11 HG11 ' B' ' 92' ' ' VAL . 17.3 mt -105.13 110.17 22.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.349 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.605 ' HE1' HG21 ' B' ' 8' ' ' VAL . 2.2 mpt? -89.46 162.58 15.66 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.47 -23.64 62.9 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -116.23 -12.56 11.16 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -159.57 166.64 30.34 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 119.703 -0.799 . . . . 0.0 112.73 -176.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.999 HD12 HD12 ' B' ' 67' ' ' LEU . 1.1 tt -112.21 119.41 60.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.835 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.54 ' HB3' ' HE3' ' B' ' 27' ' ' MET . . . -120.16 151.89 38.44 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.328 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.827 ' HB2' HD11 ' B' ' 24' ' ' LEU . 27.1 t90 -146.9 139.77 25.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -124.76 143.87 44.94 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.274 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.527 ' O ' ' HB2' ' B' ' 38' ' ' LYS . 28.3 Cg_exo -61.85 159.95 31.28 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.476 2.118 . . . . 0.0 111.662 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.413 ' N ' ' HA2' ' B' ' 22' ' ' GLY . 5.3 tp10 -57.34 130.52 46.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.21 0.529 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.0 29.81 75.75 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.031 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.527 ' HB2' ' O ' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.15 151.28 31.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.056 0.428 . . . . 0.0 110.843 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -98.65 -22.08 16.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.013 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -108.67 140.92 41.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.651 -178.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -84.74 124.59 31.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.011 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.4 p -92.58 -13.65 29.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.281 0.562 . . . . 0.0 110.594 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.727 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -114.09 124.89 71.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.135 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.0 t -147.81 102.84 3.45 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -124.5 137.41 54.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.487 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.7 mmm -89.16 138.89 31.02 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.691 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.7 m-85 -56.97 -24.39 52.82 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.301 0.572 . . . . 0.0 110.358 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.27 -32.65 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.614 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.563 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -91.58 -11.87 36.0 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 123.538 0.524 . . . . 0.0 111.604 -178.272 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.664 ' HB ' HD21 ' B' ' 100' ' ' LEU . 1.5 mm -83.57 135.69 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 18.0 ttpp -87.18 -47.69 8.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 4.7 p -167.73 -177.77 3.6 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.318 -1.31 . . . . 0.0 108.273 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -135.05 144.04 47.05 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.616 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.022 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 48.1 mttp -102.16 148.31 25.56 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.515 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.7 OUTLIER -125.78 127.84 71.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 176.542 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.9 p -91.3 115.62 64.78 Favored Pre-proline 0 C--O 1.25 1.111 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -67.6 173.14 9.36 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 125.125 3.883 . . . . 0.0 114.042 -177.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -59.28 160.05 7.01 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.123 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.52 -29.05 8.13 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.534 -1.427 . . . . 0.0 109.534 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.61 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 5.1 mttm -86.9 153.18 21.81 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.37 -16.21 64.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.242 0.544 . . . . 0.0 110.493 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.902 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.31 138.38 38.31 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.926 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.624 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -80.34 131.61 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.54 162.91 30.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -176.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.671 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -140.38 153.89 46.52 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.068 -1.424 . . . . 0.0 107.719 177.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.022 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -145.7 142.43 28.98 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.973 0.806 . . . . 0.0 110.483 178.176 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.999 HD12 HD12 ' B' ' 31' ' ' ILE . 39.8 mt -94.0 106.94 18.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.024 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.472 ' HA ' HG22 ' B' ' 74' ' ' THR . 8.1 t -94.24 113.84 29.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.042 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.53 HD21 HD13 ' B' ' 50' ' ' ILE . 3.2 mt -98.36 158.9 15.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.021 0.439 . . . . 0.0 112.066 -177.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.563 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -81.18 0.02 38.38 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.297 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.67 -3.47 56.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.531 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.91 19.96 56.68 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . 0.406 ' HB3' HD11 ' B' ' 69' ' ' LEU . 18.9 t70 -126.04 157.41 38.01 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.559 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.528 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 20.3 p -137.15 130.86 31.74 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.53 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 0.8 OUTLIER -107.96 105.34 15.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.157 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -86.36 128.46 34.94 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 112.534 -177.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.727 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 50.3 m-85 -114.32 110.03 19.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.397 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.568 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.5 t-160 -86.82 113.35 22.56 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.026 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.671 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 46.0 m-85 -80.18 92.33 5.68 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.31 27.66 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.926 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.541 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -107.14 91.33 3.61 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -35.51 4.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.19 -0.914 . . . . 0.0 113.337 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 57.1 m -58.88 -59.99 4.57 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.503 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.8 p -127.9 9.99 6.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.658 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -42.8 -50.15 5.68 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 113.863 1.061 . . . . 0.0 113.863 -177.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.463 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.92 -52.79 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.909 0.385 . . . . 0.0 110.992 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.503 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -66.73 -35.49 80.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.138 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.636 ' O ' HG22 ' B' ' 92' ' ' VAL . 12.3 mt-10 -64.97 -45.46 85.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.624 ' HD3' HG23 ' B' ' 63' ' ' ILE . 20.6 ttp180 -55.22 -47.51 75.24 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.5 -45.27 93.77 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.799 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.7 -42.44 82.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 117.843 0.292 . . . . 0.0 111.26 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.938 HG11 HD11 ' B' ' 26' ' ' LEU . 45.8 t -62.36 -42.26 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -53.46 58.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.69 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -57.82 -54.65 44.46 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.045 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.89 ' HG ' HD11 ' B' ' 99' ' ' LEU . 13.1 tp -60.67 -40.33 91.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.137 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.477 HD12 HG12 ' B' ' 92' ' ' VAL . 22.7 mt -69.72 -45.86 67.24 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.729 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -65.03 -18.39 65.26 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.745 0.783 . . . . 0.0 109.544 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 33.4 mm-40 -84.79 -50.86 7.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.981 178.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.89 HD11 ' HG ' ' B' ' 95' ' ' LEU . 9.3 mt -78.41 -45.91 21.18 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.691 HD23 ' HB3' ' B' ' 47' ' ' TYR . 32.7 mt -51.58 -51.23 71.58 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -176.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.403 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 45.4 Cg_endo -67.36 -24.96 42.57 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.198 1.932 . . . . 0.0 114.341 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 32.3 mttm -63.82 -31.67 72.93 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.003 0.43 . . . . 0.0 111.804 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 . . . . . 0 C--N 1.322 -0.621 0 CA-C-O 121.665 0.745 . . . . 0.0 110.485 -179.146 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.434 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 5.3 pt-20 . . . . . 0 C--O 1.222 -0.368 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.469 ' HB3' ' HE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.5 87.19 2.24 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.17 -176.799 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.554 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -138.75 -50.31 0.54 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.287 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.33 13.63 0.42 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.546 0.688 . . . . 0.0 110.264 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.874 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.62 127.51 31.74 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.144 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . 0.417 ' O ' ' HA ' ' B' ' 54' ' ' LYS . 2.9 m-80 . . . . . 0 C--N 1.317 -0.839 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.896 -178.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.6 t . . . . . 0 CA--C 1.515 -0.384 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.402 ' HB2' HD22 ' B' ' 95' ' ' LEU . 19.5 mt -88.28 -28.85 20.82 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.486 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.403 ' CD2' HG21 ' B' ' 92' ' ' VAL . 5.9 tp -135.61 136.85 41.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.9 mt -121.66 120.14 60.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.778 HG22 HD21 ' B' ' 24' ' ' LEU . 3.5 t -110.89 150.02 13.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.463 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.542 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.1 mtmp? -116.4 175.89 5.35 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.406 -178.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.468 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.3 OUTLIER 17.87 70.9 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.679 0 O-C-N 125.346 1.654 . . . . 0.0 113.293 -178.527 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 13' ' ' LYS . 11.7 t -114.92 121.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.073 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.565 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 73.4 mtp85 -92.49 120.92 33.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.436 HE21 ' HB3' ' B' ' 17' ' ' GLN . 0.6 OUTLIER -113.27 103.37 11.25 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 178.311 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 57.5 mttp 63.76 56.44 1.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.076 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 68.51 21.23 8.19 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.765 177.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.565 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tt0 -133.7 122.6 23.61 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.831 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.03 153.44 43.2 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.92 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.665 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 177.98 -170.75 43.13 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 116.148 -0.478 . . . . 0.0 112.706 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 131.74 54.04 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.944 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.31 139.1 33.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.542 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . 0.458 ' CD2' ' HE1' ' B' ' 41' ' ' PHE . 71.3 m-85 -132.7 122.75 25.08 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.866 HD12 HG12 ' B' ' 92' ' ' VAL . 14.0 mt -102.11 116.43 32.66 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.458 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.522 ' HE1' ' HB2' ' B' ' 32' ' ' ALA . 1.8 mpt? -93.99 162.45 13.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.44 -8.76 6.66 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -127.9 -16.13 4.7 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -158.24 160.5 37.19 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.439 -176.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.965 HD12 HD11 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.37 118.66 53.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.968 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.522 ' HB2' ' HE1' ' B' ' 27' ' ' MET . . . -119.14 154.17 33.69 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.415 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.944 ' HB2' HD11 ' B' ' 24' ' ' LEU . 55.2 t90 -146.87 129.42 15.96 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.41 ' HB1' ' CD1' ' B' ' 41' ' ' PHE . . . -109.96 121.82 40.77 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.312 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.03 139.46 42.82 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.469 2.112 . . . . 0.0 111.833 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.665 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.0 mt-10 -57.92 132.04 52.22 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.628 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.09 -7.48 64.53 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.141 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -113.37 152.94 29.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.583 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -97.55 -7.32 31.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.36 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -124.24 152.02 43.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.109 0.48 . . . . 0.0 111.938 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.458 ' HE1' ' CD2' ' B' ' 25' ' ' TYR . 44.8 m-85 -81.16 121.81 26.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.901 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 12.7 p -91.46 -9.85 43.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 110.111 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.776 HG22 ' HZ ' ' B' ' 77' ' ' PHE . 19.0 mm -117.34 119.99 63.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.159 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 27.7 t -148.04 101.43 3.29 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.47 ' CD2' HG23 ' B' ' 43' ' ' ILE . 66.0 m-70 -125.99 132.95 51.93 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.485 ' O ' HG12 ' B' ' 50' ' ' ILE . 50.9 mtp -86.6 143.38 27.68 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.687 ' HB3' HD21 ' B' ' 100' ' ' LEU . 19.9 m-85 -59.92 -22.09 61.97 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.195 0.521 . . . . 0.0 109.959 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.86 -3.31 31.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.707 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.561 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 12.4 m-20 -118.78 -9.99 10.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.252 0.549 . . . . 0.0 110.105 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.801 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.3 mm -92.39 127.7 44.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.493 ' HB2' ' HB3' ' B' ' 70' ' ' HIS . 29.1 tttp -87.15 -49.49 7.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.477 0.656 . . . . 0.0 110.069 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.08 -177.43 5.91 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.188 -178.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . 0.421 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 24.3 pt20 -144.49 146.78 32.6 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.969 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.093 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 39.3 mttp -109.06 146.18 34.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 177.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.512 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -125.11 128.54 73.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 176.211 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -90.87 118.66 68.77 Favored Pre-proline 0 C--O 1.25 1.105 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -178.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.55 173.03 13.14 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 125.196 3.931 . . . . 0.0 114.017 -177.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -61.35 160.24 11.12 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.79 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.84 -28.97 8.09 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -177.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.434 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 3.6 mttm -87.41 164.78 16.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.44 -14.96 57.86 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.314 0.578 . . . . 0.0 109.924 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.628 ' HZ1' ' CG ' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -133.46 129.79 37.72 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.445 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.438 HG22 ' HA ' ' B' ' 86' ' ' VAL . 2.7 mp -77.98 129.6 37.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 177.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -135.67 163.63 29.71 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.686 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.8 tp -138.84 153.43 48.34 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 113.069 -1.878 . . . . 0.0 106.906 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.093 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.32 140.98 26.83 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 119.07 0.85 . . . . 0.0 110.33 178.336 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.965 HD11 HD12 ' B' ' 31' ' ' ILE . 94.3 mt -94.02 111.22 22.91 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.444 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.573 ' HA ' HG21 ' B' ' 74' ' ' THR . 15.0 t -95.73 102.83 14.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.727 HD23 HD12 ' B' ' 50' ' ' ILE . 1.3 mt -84.06 152.89 24.11 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.942 -176.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.561 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 1.6 p-80 -81.38 6.4 14.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.695 0.759 . . . . 0.0 109.004 178.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.82 -22.04 46.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.226 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.93 4.51 24.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.184 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . 0.511 ' OD2' HD13 ' B' ' 69' ' ' LEU . 4.5 p-10 -126.65 175.95 7.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.075 0.464 . . . . 0.0 111.807 -179.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.573 HG21 ' HA ' ' B' ' 68' ' ' VAL . 14.2 p -136.85 146.83 46.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -179.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.541 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 18.6 m -122.24 103.47 8.79 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.108 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . 0.431 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 6.8 m-20 -81.98 150.86 27.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.265 0.555 . . . . 0.0 112.273 -178.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.776 ' HZ ' HG22 ' B' ' 43' ' ' ILE . 44.5 m-85 -137.34 117.85 13.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.31 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.628 ' CG ' ' HZ1' ' B' ' 62' ' ' LYS . 4.5 t-160 -92.15 113.69 26.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.708 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.686 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 65.2 m-85 -83.7 93.16 7.86 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.71 3.48 53.84 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.468 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.9 t-20 -85.1 91.19 8.05 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.09 -41.9 2.76 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.427 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.35 -59.84 3.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 20.8 p -127.78 7.93 6.25 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -176.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.578 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -41.1 -52.89 3.17 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.438 ' HA ' HG22 ' B' ' 63' ' ' ILE . 2.2 t -57.67 -49.11 81.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.471 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 5.8 mptt -70.06 -31.95 69.82 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.626 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.2 mt-10 -65.92 -44.1 86.15 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.488 ' HD2' HD12 ' B' ' 55' ' ' ILE . 23.4 ttp180 -56.51 -47.56 79.05 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . 0.621 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -63.39 -44.69 93.98 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.38 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.13 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.884 0.311 . . . . 0.0 111.424 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.866 HG12 HD12 ' B' ' 26' ' ' LEU . 57.0 t -59.81 -45.11 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.621 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.6 tmmt? -58.55 -54.56 45.72 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.007 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.07 -54.43 30.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.101 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.84 ' HG ' HD13 ' B' ' 99' ' ' LEU . 14.8 tp -65.29 -30.6 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.025 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.483 HD12 HG13 ' B' ' 92' ' ' VAL . 24.0 mt -76.18 -42.58 45.91 Favored 'General case' 0 C--O 1.216 -0.676 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -60.81 -24.52 65.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.379 1.085 . . . . 0.0 108.745 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.98 -46.62 11.86 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.551 -1.659 . . . . 0.0 111.363 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.84 HD13 ' HG ' ' B' ' 95' ' ' LEU . 11.5 mt -86.78 -28.11 23.18 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -176.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.801 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.3 mt -67.57 -58.64 8.15 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.0 -21.67 72.81 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.888 1.725 . . . . 0.0 112.993 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' B' ' 99' ' ' LEU . 3.8 ptmm? -87.91 2.2 52.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.598 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.477 ' HD2' ' O ' ' B' ' 99' ' ' LEU . 11.2 m-85 . . . . . 0 N--CA 1.463 0.211 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.747 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 20.9 tt0 . . . . . 0 CA--C 1.518 -0.275 0 N-CA-C 111.259 0.096 . . . . 0.0 111.259 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.564 ' HB3' ' HE2' ' A' ' 403' ' ' PHE . 5.1 m-20 -150.35 82.58 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.579 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.6 p-10 -139.01 -42.31 0.47 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.18 15.83 0.15 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.72 0.771 . . . . 0.0 110.93 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 1.054 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -55.86 132.31 49.21 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.693 179.307 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 . . . . . 0 C--N 1.315 -0.908 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.369 -178.858 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.519 HG21 ' HE3' ' B' ' 27' ' ' MET . 90.9 t . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.802 0.334 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.407 ' HB2' HD21 ' B' ' 95' ' ' LEU . 45.3 mt -94.73 -30.36 14.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.618 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.0 tp -136.64 135.11 38.01 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 77.8 mt -118.55 119.55 61.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.695 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 2.8 t -108.46 148.64 12.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.812 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.564 ' O ' HG21 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.11 173.59 6.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.114 -178.627 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 17.75 68.24 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 O-C-N 125.163 1.539 . . . . 0.0 114.214 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.564 HG21 ' O ' ' B' ' 13' ' ' LYS . 24.4 t -117.08 126.85 74.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.628 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 12.0 mtt180 -99.18 133.64 43.18 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.36 0.6 . . . . 0.0 111.65 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.53 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 4.8 tp-100 -111.21 107.47 16.8 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.415 ' HA ' ' HZ1' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 66.53 46.53 1.84 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.733 0.778 . . . . 0.0 109.264 -179.12 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.435 ' HZ2' ' HG2' ' B' ' 19' ' ' LYS . 0.3 OUTLIER 67.35 23.64 9.18 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.896 179.275 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.616 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.2 tt0 -122.16 119.19 30.57 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.381 -0.199 . . . . 0.0 110.776 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.481 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 1.2 m-20 -58.85 146.66 36.56 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.709 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 178.67 -169.39 40.89 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.082 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.28 137.2 53.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.949 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.48 137.79 35.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.917 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . 0.417 ' CD1' ' HE2' ' B' ' 41' ' ' PHE . 68.6 m-85 -131.96 117.4 18.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.741 HD13 HG11 ' B' ' 92' ' ' VAL . 12.3 mt -100.42 119.12 37.98 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.501 -178.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.519 ' HE3' HG21 ' B' ' 8' ' ' VAL . 2.3 mpt? -95.44 161.85 13.9 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -20.43 63.14 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.54 -22.2 11.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -178.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . 0.487 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 1.6 ptp180 -155.28 160.86 41.11 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.713 -0.795 . . . . 0.0 112.592 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.794 HD13 HD13 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -104.0 122.15 56.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 114.81 -1.086 . . . . 0.0 108.282 179.028 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.4 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -125.84 155.37 41.27 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.182 0.515 . . . . 0.0 111.29 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.949 ' HB2' HD12 ' B' ' 24' ' ' LEU . 50.4 t90 -147.23 134.69 20.83 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.904 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -117.67 133.77 23.27 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.033 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.977 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 2.3 Cg_endo -77.14 146.38 25.35 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.377 2.051 . . . . 0.0 111.923 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.709 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 34.3 mt-10 -64.01 129.46 40.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.297 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.45 -0.02 61.35 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.439 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.977 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.9 mptt -113.42 154.37 27.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.322 . . . . 0.0 110.768 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -100.94 4.72 42.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.451 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -140.03 157.17 46.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.209 0.528 . . . . 0.0 111.895 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.417 ' HE2' ' CD1' ' B' ' 25' ' ' TYR . 61.2 m-85 -85.21 126.05 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.756 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.7 p -93.07 -19.07 21.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.263 0.554 . . . . 0.0 110.381 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.699 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 37.1 mm -110.71 118.63 57.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.23 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 43.6 t -147.8 101.33 3.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -126.36 138.82 53.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.785 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.509 ' O ' HG12 ' B' ' 50' ' ' ILE . 18.9 mmt -84.33 144.23 28.98 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.678 ' HB3' HD22 ' B' ' 100' ' ' LEU . 21.8 m-85 -61.45 -20.6 63.3 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.962 0.41 . . . . 0.0 110.564 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.59 -11.36 60.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.436 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.574 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.05 -11.56 15.28 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.204 0.526 . . . . 0.0 109.655 179.277 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.631 ' HB ' HD23 ' B' ' 100' ' ' LEU . 1.2 mm -91.38 131.0 39.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -87.83 -43.38 11.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.359 0.6 . . . . 0.0 109.745 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.495 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.9 p -164.94 -177.59 4.75 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.261 -0.882 . . . . 0.0 109.602 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.67 142.2 41.13 Favored 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.126 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.054 ' HD3' ' HB3' ' A' ' 403' ' ' PHE . 50.2 mttp -105.28 150.89 24.76 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.535 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -126.95 129.39 71.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' SER . . . . . 0.463 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -93.41 121.49 64.97 Favored Pre-proline 0 C--O 1.252 1.21 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -68.15 172.89 10.29 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 125.071 3.847 . . . . 0.0 114.53 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -63.44 160.43 16.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.39 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.75 -29.19 7.97 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.747 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 22.7 mttp -88.47 155.2 19.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.47 -17.69 63.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.974 0.416 . . . . 0.0 110.991 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.593 ' HD3' ' CE1' ' B' ' 78' ' ' HIS . 17.3 pttt -132.47 134.21 44.78 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.731 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.615 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -78.84 134.9 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.615 ' OE1' ' HD3' ' B' ' 60' ' ' LYS . 0.2 OUTLIER -134.0 163.04 30.43 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 118.085 -1.446 . . . . 0.0 114.811 -176.165 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.423 ' HA ' ' O ' ' B' ' 54' ' ' LYS . 2.2 tp -141.95 153.51 44.38 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 113.111 -1.859 . . . . 0.0 107.24 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.006 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.53 141.71 28.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 118.93 0.787 . . . . 0.0 110.52 178.567 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.794 HD13 HD13 ' B' ' 31' ' ' ILE . 96.1 mt -93.83 100.28 12.49 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.884 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.607 ' HA ' HG22 ' B' ' 74' ' ' THR . 11.4 t -86.15 111.88 21.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.463 HD22 HD13 ' B' ' 50' ' ' ILE . 6.4 mt -94.26 156.6 16.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.998 0.428 . . . . 0.0 111.543 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.574 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -80.16 -1.4 40.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.248 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.28 -3.96 56.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.542 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.11 19.41 53.23 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.54 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . 0.463 ' HB3' HD12 ' B' ' 69' ' ' LEU . 21.7 t70 -125.96 158.9 34.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.254 . . . . 0.0 110.533 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.607 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.5 p -137.87 131.05 30.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.234 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.544 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.6 m -107.39 103.42 12.76 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.69 143.85 30.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.072 0.463 . . . . 0.0 112.162 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.699 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 41.6 m-85 -126.64 127.26 44.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.222 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.628 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.5 t-160 -92.37 101.3 13.77 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.178 -178.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.709 ' HZ ' HG23 ' B' ' 92' ' ' VAL . 24.8 m-85 -79.37 99.52 7.19 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.79 9.9 24.69 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.8 91.43 7.05 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.636 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.83 -41.94 1.69 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.451 -178.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -59.75 4.78 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.424 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.7 p -127.79 7.34 6.18 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 115.747 1.758 . . . . 0.0 115.747 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.703 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.73 -47.33 7.87 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.401 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.76 -51.44 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 111.084 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.5 mptt -69.06 -34.26 74.88 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.053 0.454 . . . . 0.0 109.858 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.673 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.9 mt-10 -64.83 -44.42 89.9 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.615 ' HD3' HG23 ' B' ' 63' ' ' ILE . 24.0 ttp180 -54.91 -47.18 74.7 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 122.052 0.929 . . . . 0.0 108.509 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . 0.565 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.51 -45.37 93.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.27 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.54 79.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.689 0.222 . . . . 0.0 111.411 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.741 HG11 HD13 ' B' ' 26' ' ' LEU . 46.8 t -61.69 -41.54 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.565 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.0 OUTLIER -59.87 -58.47 8.42 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.545 177.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.7 -51.42 63.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.937 -1.028 . . . . 0.0 112.31 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.733 ' HG ' HD11 ' B' ' 99' ' ' LEU . 15.5 tp -62.04 -42.61 99.36 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.844 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.433 HD11 HG12 ' B' ' 92' ' ' VAL . 20.7 mt -68.89 -41.03 78.84 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -64.2 -23.45 67.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 122.094 0.95 . . . . 0.0 109.116 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -84.08 -50.82 7.6 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.237 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.733 HD11 ' HG ' ' B' ' 95' ' ' LEU . 14.3 mt -75.25 -49.86 17.95 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 113.47 -1.696 . . . . 0.0 115.103 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.678 HD22 ' HB3' ' B' ' 47' ' ' TYR . 54.6 mt -50.36 -58.41 9.89 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.594 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.9 Cg_exo -54.96 -20.71 23.96 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.19 1.927 . . . . 0.0 113.448 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -88.0 -6.79 57.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.764 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 . . . . . 0 C--N 1.331 -0.235 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.599 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.837 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 51.0 tt0 . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.65 ' HB3' ' HE2' ' A' ' 403' ' ' PHE . 3.5 m-20 -144.95 89.63 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.521 -177.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.544 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.0 -48.11 0.49 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -74.39 20.57 0.11 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.694 0.759 . . . . 0.0 111.18 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.65 ' HE2' ' HB3' ' A' ' 400' ' ' ASP . 0.4 OUTLIER -54.37 132.09 43.43 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.328 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.319 -0.719 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.963 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.443 HG22 ' HE1' ' B' ' 27' ' ' MET . 63.7 t . . . . . 0 N--CA 1.445 -0.707 0 CA-C-O 121.153 0.501 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 31.8 mt -81.3 -33.8 32.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.623 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.403 ' CD2' HG23 ' B' ' 92' ' ' VAL . 6.2 tp -132.11 128.63 38.55 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.423 HG12 HG11 ' B' ' 8' ' ' VAL . 66.3 mt -111.64 122.0 65.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.825 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.6 t -113.57 149.89 15.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.598 ' O ' HG22 ' B' ' 15' ' ' VAL . 1.5 mtmp? -116.71 179.32 4.04 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.666 -178.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 18.21 66.87 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 O-C-N 125.356 1.66 . . . . 0.0 113.491 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.598 HG22 ' O ' ' B' ' 13' ' ' LYS . 14.9 t -115.05 123.67 70.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.482 179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.631 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 54.3 mtt85 -97.44 122.34 40.37 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.233 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.693 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 0.7 OUTLIER -104.84 102.31 11.86 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 178.868 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.7 mttt 51.53 61.52 3.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.735 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.77 12.82 1.39 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 177.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.742 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 7.0 pt20 -130.52 125.88 35.41 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.393 0.997 . . . . 0.0 111.007 178.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -80.33 152.74 28.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -177.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 175.68 -159.17 26.76 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.948 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.23 137.53 52.91 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.907 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.21 140.25 35.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.729 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . 0.436 ' CD2' ' HE2' ' B' ' 41' ' ' PHE . 55.4 m-85 -134.83 122.9 22.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.81 HD11 HG12 ' B' ' 92' ' ' VAL . 15.8 mt -103.18 118.01 35.83 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.564 -0.455 . . . . 0.0 111.797 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.733 ' HE3' ' HB1' ' B' ' 32' ' ' ALA . 1.8 mpt? -93.36 163.01 13.76 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.08 -21.98 60.07 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -115.25 -15.46 11.61 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . 0.518 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -158.83 166.6 31.52 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 119.744 -0.782 . . . . 0.0 112.892 -177.007 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.834 HD12 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -110.23 122.46 64.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.912 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.733 ' HB1' ' HE3' ' B' ' 27' ' ' MET . . . -124.14 152.81 42.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.085 0.469 . . . . 0.0 110.656 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.907 ' HB2' HD11 ' B' ' 24' ' ' LEU . 25.2 t90 -146.96 140.08 25.32 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.416 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -128.82 140.0 37.27 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.522 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.841 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 22.0 Cg_exo -64.02 158.48 47.39 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.625 2.217 . . . . 0.0 111.752 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.23 122.03 11.51 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.383 0.611 . . . . 0.0 111.967 -178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.36 29.73 59.64 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.308 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.841 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.48 146.72 39.14 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.046 0.423 . . . . 0.0 110.295 178.837 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -92.91 -20.75 20.33 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.938 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -113.18 144.43 42.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.48 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.436 ' HE2' ' CD2' ' B' ' 25' ' ' TYR . 84.5 m-85 -85.74 122.43 29.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.727 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.82 -17.5 33.27 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.351 0.596 . . . . 0.0 110.278 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.703 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -112.64 119.86 61.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.153 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.0 t -148.0 101.45 3.29 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.484 ' CD2' HG22 ' B' ' 43' ' ' ILE . 61.6 m-70 -126.59 131.09 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.669 0.271 . . . . 0.0 110.282 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.518 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 67.8 mmm -83.36 143.12 30.54 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.648 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.87 -24.21 56.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.025 0.441 . . . . 0.0 110.571 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.16 -9.03 58.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.922 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.627 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 34.7 m-20 -109.92 -8.83 14.81 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.214 0.53 . . . . 0.0 110.039 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.527 ' HB ' HD21 ' B' ' 100' ' ' LEU . 1.0 OUTLIER -88.28 129.47 39.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.049 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 31.0 tttp -86.01 -38.72 17.6 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.647 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.3 p -167.24 178.81 5.39 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.513 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -142.41 135.82 28.91 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.416 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.985 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 34.0 mttm -105.79 155.5 19.23 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.001 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.523 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.7 OUTLIER -128.12 129.99 69.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 176.453 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.42 122.37 63.05 Favored Pre-proline 0 C--O 1.25 1.107 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.661 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.21 172.89 11.3 Favored 'Trans proline' 0 C--O 1.235 0.342 1 C-N-CA 125.48 4.12 . . . . 0.0 114.657 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -65.14 160.41 21.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.824 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.42 -28.99 8.21 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.837 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 7.5 mttp -85.76 162.38 18.74 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.98 -17.73 60.49 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.114 0.483 . . . . 0.0 110.331 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.634 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 13.8 pttp -135.16 133.89 39.61 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.149 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.566 HG22 ' HD3' ' B' ' 89' ' ' ARG . 2.1 mp -79.58 129.91 36.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.528 ' OE1' ' HD3' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -133.13 163.68 28.73 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -175.11 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.505 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -139.37 153.02 47.59 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 112.963 -1.926 . . . . 0.0 106.432 176.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 0.985 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.1 135.33 22.82 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 119.405 1.002 . . . . 0.0 111.545 179.408 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.834 HD11 HD12 ' B' ' 31' ' ' ILE . 76.7 mt -93.72 99.18 11.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.477 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.647 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.2 t -85.11 105.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.46 HD22 HD12 ' B' ' 50' ' ' ILE . 4.3 mt -89.88 155.7 18.97 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.146 0.498 . . . . 0.0 112.08 -177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.627 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -81.4 4.32 21.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.718 0.771 . . . . 0.0 109.002 177.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -86.27 -5.84 59.1 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.206 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.46 13.96 56.33 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.095 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -126.27 155.14 42.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.761 0.315 . . . . 0.0 110.848 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.516 HG22 ' HA ' ' B' ' 68' ' ' VAL . 10.0 p -127.37 131.23 50.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.521 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.554 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.84 98.75 8.38 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.787 0.327 . . . . 0.0 110.16 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . 0.449 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 2.7 m-20 -86.29 147.95 25.84 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.096 0.474 . . . . 0.0 111.381 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.703 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 61.4 m-85 -131.9 116.57 17.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.691 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.525 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.9 t-160 -86.95 103.48 15.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.61 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.701 ' HB3' ' HB2' ' B' ' 85' ' ' ALA . 51.2 m-85 -76.5 96.91 4.19 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.96 19.53 20.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.411 HD21 ' HA ' ' B' ' 81' ' ' ASN . 1.0 OUTLIER -90.91 93.6 9.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.291 0.567 . . . . 0.0 109.589 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.76 -32.64 0.63 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.01 -59.47 2.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.539 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.5 p -127.39 10.86 6.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -176.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.701 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -43.39 -52.1 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.477 HG21 HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.75 -50.58 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.691 0.281 . . . . 0.0 111.221 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.539 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.7 mttt -67.53 -33.63 75.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.64 ' O ' HG22 ' B' ' 92' ' ' VAL . 12.1 mt-10 -64.63 -44.41 90.59 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.566 ' HD3' HG22 ' B' ' 63' ' ' ILE . 20.7 ttp180 -56.43 -47.1 79.79 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.68 -41.9 99.34 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.757 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.8 -41.47 78.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.614 0.188 . . . . 0.0 111.243 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.81 HG12 HD11 ' B' ' 26' ' ' LEU . 38.6 t -62.4 -43.53 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.06 -52.79 64.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.096 178.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -57.16 -53.49 57.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.605 -179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.814 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.3 tp -63.61 -36.98 85.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.008 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.8 mt -70.42 -45.1 66.56 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 110.43 -0.211 . . . . 0.0 110.43 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -62.43 -21.27 65.28 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.007 0.908 . . . . 0.0 109.461 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.34 -47.41 9.39 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.194 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.814 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.2 mt -81.44 -46.29 14.79 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -176.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.648 HD23 ' HB3' ' B' ' 47' ' ' TYR . 38.3 mt -52.38 -58.19 12.62 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.608 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 59.2 Cg_exo -54.68 -19.85 19.84 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.325 2.016 . . . . 0.0 113.829 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -84.88 -21.19 29.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 0.0 111.346 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 C--N 1.327 -0.377 0 CA-C-O 120.659 0.266 . . . . 0.0 111.355 -179.471 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.905 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.5 tt0 . . . . . 0 CA--C 1.513 -0.452 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.667 ' HB3' HD22 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -136.37 89.52 2.48 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 -176.199 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.492 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.0 p-10 -139.31 -46.6 0.46 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -72.92 9.37 1.18 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.24 0.543 . . . . 0.0 110.846 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.641 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -50.25 120.26 4.37 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.033 179.812 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.32 -0.717 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.325 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 42.9 t . . . . . 0 CA--C 1.52 -0.195 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.9 mt -91.09 -29.34 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.931 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.49 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -139.65 131.32 27.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 78.9 mt -115.05 122.68 69.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.843 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.7 t -114.33 150.34 16.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.637 ' O ' HG21 ' B' ' 15' ' ' VAL . 1.7 mtmp? -114.8 177.22 4.73 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.488 -178.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.561 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.71 73.33 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 O-C-N 125.152 1.533 . . . . 0.0 113.343 -178.395 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.725 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.6 t -126.12 129.36 72.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.396 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.684 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 0.3 OUTLIER -99.6 145.19 27.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.053 0.454 . . . . 0.0 111.332 179.666 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.647 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -132.48 103.22 6.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.169 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.45 ' HG3' HE22 ' B' ' 17' ' ' GLN . 35.2 mttp 58.82 54.39 5.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.929 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? 72.19 23.99 3.22 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.898 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.684 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 36.9 mt-30 -126.29 119.63 27.88 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.545 ' HA ' ' HG3' ' B' ' 16' ' ' ARG . 0.8 OUTLIER -85.36 139.18 31.77 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.86 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -174.37 -151.06 8.07 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.753 -0.736 . . . . 0.0 113.589 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.3 140.18 52.38 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 122.73 0.412 . . . . 0.0 110.008 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.919 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -102.03 145.7 28.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.471 -178.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -139.33 112.77 8.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.735 0.303 . . . . 0.0 110.357 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.952 HD11 HG13 ' B' ' 92' ' ' VAL . 12.1 mt -90.27 137.23 32.51 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.13 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.517 ' HB3' ' NH2' ' B' ' 30' ' ' ARG . 42.8 mtt -120.8 167.19 12.77 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.028 -178.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.14 -49.76 8.89 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -122.75 11.59 9.76 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.458 -178.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . 0.562 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.0 OUTLIER -159.6 156.4 27.92 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.253 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 1.0 HD11 HD12 ' B' ' 67' ' ' LEU . 1.5 tt -111.59 122.01 65.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -120.17 150.84 40.0 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.983 0.42 . . . . 0.0 110.775 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.919 ' HB2' HD11 ' B' ' 24' ' ' LEU . 48.2 t90 -146.99 141.2 26.19 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.857 ' HB1' ' HD3' ' B' ' 38' ' ' LYS . . . -139.6 129.46 14.11 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.56 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.86 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 21.1 Cg_endo -62.87 167.42 12.1 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.873 2.382 . . . . 0.0 112.489 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.543 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 72.4 mt-10 -81.65 124.0 29.19 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.479 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 118.36 -30.29 6.07 Favored Glycine 0 C--O 1.228 -0.281 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.766 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.857 ' HD3' ' HB1' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -75.14 171.73 13.64 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.499 0.666 . . . . 0.0 111.762 -179.943 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . 0.508 ' OD1' ' HG3' ' B' ' 40' ' ' ARG . 18.1 p-10 -115.74 -23.07 8.84 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.168 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.508 ' HG3' ' OD1' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -117.72 149.54 40.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.368 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.472 ' HA ' ' HB3' ' B' ' 34' ' ' ALA . 50.5 m-85 -70.32 154.61 41.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.576 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.8 p -115.48 -43.3 3.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.258 0.552 . . . . 0.0 109.801 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.647 HG13 ' HG3' ' B' ' 17' ' ' GLN . 18.6 mm -91.44 121.21 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.931 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 23.0 t -147.64 101.39 3.33 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.412 ' CD2' HG23 ' B' ' 43' ' ' ILE . 77.5 m-70 -125.94 138.78 53.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.919 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.562 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 78.8 mmm -88.85 143.75 26.68 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.543 ' CE1' HD11 ' B' ' 99' ' ' LEU . 21.9 m-30 -58.12 -20.73 42.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.304 0.573 . . . . 0.0 109.802 178.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . 0.507 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -72.81 -18.52 61.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.81 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.644 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.79 -6.36 21.53 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 123.46 0.475 . . . . 0.0 110.232 -179.731 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.562 HD13 HD21 ' B' ' 69' ' ' LEU . 1.6 mm -90.37 130.58 39.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -91.06 -44.41 9.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.488 0.661 . . . . 0.0 110.427 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.615 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.2 p -158.25 -177.31 6.46 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.497 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . 0.446 HE22 ' HB2' ' B' ' 96' ' ' LEU . 5.0 pt20 -145.3 148.77 33.8 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.793 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.077 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 42.2 mttm -117.03 154.11 31.5 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 176.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.677 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -130.22 128.72 64.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.801 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.6 p -88.81 119.8 69.99 Favored Pre-proline 0 C--O 1.249 1.042 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.155 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.76 173.54 13.79 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 125.255 3.97 . . . . 0.0 114.275 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -59.45 160.93 6.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.127 178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.18 -29.25 7.79 Favored Glycine 0 C--N 1.317 -0.477 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -177.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.905 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.5 mttp -89.51 153.14 21.03 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.29 -3.36 16.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.249 0.547 . . . . 0.0 110.64 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.81 154.26 45.09 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.288 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.609 HG21 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -99.85 135.23 36.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -137.79 162.95 32.58 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.844 -1.142 . . . . 0.0 113.991 -177.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.623 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.4 tp -139.92 153.66 47.01 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.276 177.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.077 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -143.87 141.3 30.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.938 0.79 . . . . 0.0 111.278 178.742 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 1.0 HD12 HD11 ' B' ' 31' ' ' ILE . 64.7 mt -97.77 103.78 15.75 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.145 178.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.615 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.8 t -87.16 105.91 15.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.562 HD21 HD13 ' B' ' 50' ' ' ILE . 3.4 mt -91.18 158.1 16.81 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.012 -177.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.644 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.15 -1.68 45.47 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.162 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.76 -10.69 59.67 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.475 -1.238 . . . . 0.0 110.314 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.84 12.86 48.75 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.058 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -126.33 158.14 36.61 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.964 0.412 . . . . 0.0 110.929 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.599 HG23 ' HA ' ' B' ' 68' ' ' VAL . 15.9 p -128.59 131.6 48.17 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.6 m -104.37 105.34 15.44 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.359 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . 0.667 HD22 ' HB3' ' A' ' 400' ' ' ASP . 5.0 m-20 -82.29 136.97 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.363 0.602 . . . . 0.0 111.956 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.415 ' HZ ' HG22 ' B' ' 43' ' ' ILE . 44.1 m-85 -121.63 110.85 16.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.598 178.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.725 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.8 t60 -86.53 99.1 11.44 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.658 -1.155 . . . . 0.0 111.804 -177.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.641 ' CE2' HG12 ' B' ' 12' ' ' VAL . 71.6 m-85 -77.26 94.24 4.11 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 178.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.18 1.54 39.17 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.561 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -79.99 91.38 5.44 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.86 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.82 -39.68 2.59 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.6 -59.62 4.36 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.505 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.4 p -127.81 9.0 6.35 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -176.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.485 ' HB3' ' HB3' ' B' ' 79' ' ' PHE . . . -43.23 -50.71 6.4 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.42 HG23 HG12 ' B' ' 63' ' ' ILE . 2.5 t -58.4 -51.91 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.82 0.343 . . . . 0.0 110.811 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.505 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.3 mttt -66.6 -35.17 79.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.874 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.642 ' O ' HG21 ' B' ' 92' ' ' VAL . 12.0 mt-10 -63.35 -46.54 86.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.609 ' HD3' HG21 ' B' ' 63' ' ' ILE . 22.2 ttp180 -55.73 -48.47 75.14 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . 0.515 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -61.56 -44.66 96.62 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.052 -1.431 . . . . 0.0 112.502 -179.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -43.19 76.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.89 0.314 . . . . 0.0 111.097 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.952 HG13 HD11 ' B' ' 26' ' ' LEU . 58.0 t -60.8 -43.57 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.677 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.2 tmmt? -60.37 -55.9 27.95 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.813 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -53.32 -55.39 25.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.891 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.753 ' HG ' HD12 ' B' ' 99' ' ' LEU . 14.0 tp -60.96 -41.25 95.99 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.96 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.483 HD13 HG11 ' B' ' 92' ' ' VAL . 27.1 mt -69.36 -42.79 74.77 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.392 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -66.0 -18.51 65.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.903 0.859 . . . . 0.0 109.368 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.02 -51.01 6.62 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.759 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.753 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -77.48 -48.15 17.83 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.451 -1.704 . . . . 0.0 115.019 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.542 HD23 ' HB3' ' B' ' 47' ' ' TYR . 19.0 mt -48.92 -56.29 16.07 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 19.6 Cg_endo -57.05 -15.33 17.21 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.27 1.98 . . . . 0.0 114.034 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.2 mttm -87.59 -20.51 26.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.507 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 26.7 m-85 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.5 ' HB2' ' HZ1' ' B' ' 62' ' ' LYS . 7.2 tt0 . . . . . 0 CA--C 1.507 -0.685 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.834 ' HB3' HD22 ' B' ' 76' ' ' ASN . 0.6 OUTLIER -170.63 83.97 0.1 Allowed 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.929 -177.625 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.7 p-10 -138.52 -46.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . 0.481 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 2.6 p30 -72.8 7.25 2.06 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.498 0.666 . . . . 0.0 110.208 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.984 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -54.1 126.51 23.01 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.794 179.467 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 . . . . . 0 C--N 1.322 -0.606 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.016 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 79.7 t . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.4 mt -84.44 -29.54 26.01 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.728 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.468 HD21 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.32 125.56 29.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.9 mt -112.68 116.07 51.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.743 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -107.05 147.77 11.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.567 ' O ' HG21 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -107.84 175.38 5.5 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.051 -178.54 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.665 ' HE2' ' HA ' ' B' ' 81' ' ' ASN . 29.3 mtpt 18.23 76.17 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 O-C-N 125.147 1.53 . . . . 0.0 113.552 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.567 HG21 ' O ' ' B' ' 13' ' ' LYS . 40.1 t -124.2 120.14 58.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.811 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.574 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 26.3 mtp180 -90.85 125.9 35.88 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.223 0.535 . . . . 0.0 111.032 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.421 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 2.8 tp-100 -117.21 112.18 20.47 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.882 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.1 OUTLIER 66.12 43.18 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.601 0.563 . . . . 0.0 110.639 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 70.59 19.28 6.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.472 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.488 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tt0 -125.93 119.22 27.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.452 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.427 ' CG ' ' HG2' ' B' ' 16' ' ' ARG . 2.2 m-20 -68.68 153.74 43.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.037 0.446 . . . . 0.0 111.689 -179.257 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 178.43 -158.88 23.83 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.038 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 134.59 49.99 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.218 0.532 . . . . 0.0 110.62 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.944 HD11 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.33 139.73 32.85 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.509 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -135.94 108.52 7.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.584 0.23 . . . . 0.0 110.417 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.936 HD12 HG12 ' B' ' 92' ' ' VAL . 9.3 mt -86.84 125.65 34.12 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.586 ' HB2' ' HD2' ' B' ' 30' ' ' ARG . 5.4 mtm -106.69 173.67 6.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.921 0.391 . . . . 0.0 111.57 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.42 -52.9 7.39 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -118.22 8.03 12.23 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . 0.586 ' HD2' ' HB2' ' B' ' 27' ' ' MET . 0.0 OUTLIER -158.7 151.0 21.55 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.95 -1.1 . . . . 0.0 112.666 -178.249 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.911 HD13 HD11 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -97.69 122.77 49.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.576 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -124.78 156.64 37.4 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.993 0.425 . . . . 0.0 110.828 -179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.944 ' HB2' HD11 ' B' ' 24' ' ' LEU . 39.1 t90 -147.12 132.72 18.78 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.447 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -114.7 136.25 22.44 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.105 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.859 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 24.0 Cg_exo -61.57 159.06 33.75 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.19 1.927 . . . . 0.0 111.062 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -62.47 134.54 56.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.308 0.575 . . . . 0.0 111.682 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 62.62 12.35 40.24 Favored Glycine 0 CA--C 1.521 0.414 0 CA-C-N 115.552 -0.749 . . . . 0.0 113.993 179.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.859 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 40.4 mttp -113.43 140.77 47.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.384 0.592 . . . . 0.0 110.807 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -85.18 -14.12 47.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.141 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.437 ' H ' ' HG2' ' B' ' 40' ' ' ARG . 2.2 ptp180 -106.13 129.9 54.12 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.188 0.518 . . . . 0.0 112.322 -178.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.447 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 45.3 m-85 -78.19 121.14 23.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.26 178.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 7.5 p -94.62 -7.72 40.1 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.634 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -119.95 118.65 57.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.306 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.2 t -148.01 101.61 3.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.823 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -124.13 137.22 54.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.464 ' O ' HG12 ' B' ' 50' ' ' ILE . 33.0 mtp -88.94 142.32 27.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.605 ' HB3' ' HA ' ' B' ' 100' ' ' LEU . 20.4 m-85 -57.5 -23.0 47.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.696 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.26 -27.21 65.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.938 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.571 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.15 -5.84 43.14 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.873 0.368 . . . . 0.0 111.147 -179.025 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.776 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -89.36 129.86 39.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.607 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 1.1 tttp -90.06 -41.39 11.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.201 0.524 . . . . 0.0 110.641 -178.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.607 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 4.7 p -163.79 -177.6 5.23 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.76 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . 0.641 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 5.5 pt20 -140.58 145.49 36.8 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.371 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.078 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 53.6 mttp -108.39 136.7 47.59 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.498 HG22 ' HG3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -118.78 124.63 73.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 176.056 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -85.04 118.35 70.7 Favored Pre-proline 0 C--O 1.25 1.102 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -178.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.88 173.24 10.46 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 125.117 3.878 . . . . 0.0 113.996 -178.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 160.5 5.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.482 -1.235 . . . . 0.0 109.885 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.13 7.91 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.49 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 5.6 mttp -86.82 153.79 21.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.57 -14.14 62.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.436 0.636 . . . . 0.0 109.944 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.5 ' HZ1' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -137.69 141.79 41.08 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.557 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.501 HG12 ' CG2' ' B' ' 86' ' ' VAL . 3.8 mp -84.27 133.81 28.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -134.57 162.89 31.03 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 118.559 -1.256 . . . . 0.0 114.359 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.474 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.82 152.96 46.94 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 113.791 -1.55 . . . . 0.0 107.909 177.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.078 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.72 145.58 30.03 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.629 0.649 . . . . 0.0 110.48 177.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.911 HD11 HD13 ' B' ' 31' ' ' ILE . 96.1 mt -96.94 111.7 23.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.052 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.516 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 12.1 t -95.54 112.86 28.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.598 HD23 HD12 ' B' ' 50' ' ' ILE . 1.7 mt -97.43 158.46 15.46 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.571 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -80.21 -1.77 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.29 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . 0.416 ' HB2' ' OD1' ' B' ' 73' ' ' ASP . . . -73.46 -16.68 61.3 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.67 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 103.02 8.66 41.4 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.899 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . 0.494 ' OD1' HD12 ' B' ' 69' ' ' LEU . 8.0 p-10 -126.42 172.24 10.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.199 0.523 . . . . 0.0 111.841 -179.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 30.4 p -137.58 143.57 41.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.574 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.552 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 16.7 m -116.82 109.38 17.02 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.504 0.322 . . . . 0.0 110.511 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . 0.834 HD22 ' HB3' ' A' ' 400' ' ' ASP . 4.9 m-20 -82.31 154.46 25.3 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.38 0.61 . . . . 0.0 112.628 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.634 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.7 m-85 -141.5 104.01 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.834 -1.075 . . . . 0.0 108.834 178.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.574 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.2 t-160 -86.9 105.28 16.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.493 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.648 ' CE1' HG11 ' B' ' 12' ' ' VAL . 48.9 m-85 -76.71 101.61 5.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.3 p -95.62 7.27 46.75 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.949 0.404 . . . . 0.0 111.69 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.665 ' HA ' ' HE2' ' B' ' 14' ' ' LYS . 63.8 t30 -86.09 90.81 8.23 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -33.66 18.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 41.1 m -58.89 -59.96 4.62 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.476 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.78 13.15 6.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.55 ' HB3' ' HB3' ' B' ' 79' ' ' PHE . . . -46.52 -45.01 18.27 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.501 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.9 t -59.57 -54.72 30.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.006 0.432 . . . . 0.0 110.563 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.476 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.7 mptt -65.56 -36.76 84.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.192 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.672 ' O ' HG21 ' B' ' 92' ' ' VAL . 14.0 mt-10 -65.04 -43.56 91.97 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.49 ' HD3' HG22 ' B' ' 63' ' ' ILE . 23.9 ttp180 -56.6 -49.26 75.45 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.51 -42.75 97.06 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.368 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -44.1 78.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.822 0.283 . . . . 0.0 110.97 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.936 HG12 HD12 ' B' ' 26' ' ' LEU . 38.9 t -60.26 -43.63 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.641 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 2.9 ttpt -60.19 -53.42 57.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.138 178.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 2.1 m-20 -56.3 -51.25 68.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.879 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.537 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.7 tp -64.89 -37.39 87.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.719 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.41 HD12 HG13 ' B' ' 92' ' ' VAL . 27.9 mt -72.31 -47.59 48.72 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 121.308 -0.157 . . . . 0.0 111.06 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' B' ' 94' ' ' ASP . 13.5 pt20 -60.01 -21.66 61.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.193 0.997 . . . . 0.0 109.143 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 1.4 mm-40 -85.94 -47.83 9.26 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.135 -1.393 . . . . 0.0 111.363 178.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.537 HD12 ' HG ' ' B' ' 95' ' ' LEU . 13.6 mt -81.84 -38.69 25.09 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.776 HD22 ' HB ' ' B' ' 50' ' ' ILE . 30.2 mt -53.14 -62.66 3.18 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -66.51 -7.7 18.64 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.815 1.677 . . . . 0.0 113.36 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 12.4 mtmm -81.26 -31.87 33.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.784 0.326 . . . . 0.0 110.309 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 . . . . . 0 C--N 1.327 -0.411 0 CA-C-O 121.196 0.522 . . . . 0.0 110.614 179.854 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.899 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 65.1 tt0 . . . . . 0 CA--C 1.506 -0.724 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.618 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 2.4 m-20 -140.87 92.05 2.47 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.451 -175.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.539 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.4 OUTLIER -139.51 -48.39 0.47 Allowed 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -73.13 17.5 0.13 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.636 0.731 . . . . 0.0 111.229 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.883 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -55.64 128.74 36.09 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.878 179.124 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 . . . . . 0 C--N 1.317 -0.838 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.4 -179.142 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 70.2 t . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.67 ' HB2' HD21 ' B' ' 95' ' ' LEU . 23.0 mt -87.04 -28.9 22.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.158 -178.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.418 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -140.1 138.24 35.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 86.1 mt -121.75 126.47 74.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.674 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.0 t -118.25 148.24 21.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.632 ' O ' HG21 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -110.62 -178.68 3.55 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.349 -179.358 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.486 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 47.8 mtpt 18.06 69.39 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 O-C-N 125.42 1.7 . . . . 0.0 113.559 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.632 HG21 ' O ' ' B' ' 13' ' ' LYS . 25.5 t -119.17 123.35 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.558 179.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.634 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 13.8 mtp-105 -98.14 121.36 39.97 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.086 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.425 HE21 ' HB3' ' B' ' 17' ' ' GLN . 0.7 OUTLIER -105.63 103.29 12.77 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.157 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 50.9 mttt 52.81 62.87 2.47 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.761 0.663 . . . . 0.0 110.937 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? 68.43 24.61 7.13 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 113.088 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.634 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 20.5 mt-30 -129.84 119.31 23.13 Favored 'General case' 0 C--O 1.222 -0.375 0 O-C-N 122.23 -0.293 . . . . 0.0 111.275 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -75.08 145.04 42.64 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.149 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.33 -167.64 39.34 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.653 -0.784 . . . . 0.0 113.613 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.86 137.68 54.69 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.125 0.57 . . . . 0.0 109.803 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.916 HD13 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -100.54 140.82 34.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.232 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -135.62 124.67 24.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.81 HD12 HG11 ' B' ' 92' ' ' VAL . 16.0 mt -108.03 122.85 47.7 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.668 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.727 ' HE3' ' HB2' ' B' ' 32' ' ' ALA . 1.4 mpt? -103.35 160.88 14.31 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.49 -22.24 54.36 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -105.96 -23.23 12.71 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' B' ' 45' ' ' HIS . 0.0 OUTLIER -160.38 172.72 16.78 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.692 -0.803 . . . . 0.0 112.879 -176.582 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.932 HD12 HD13 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -112.67 122.89 67.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.742 178.3 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.727 ' HB2' ' HE3' ' B' ' 27' ' ' MET . . . -122.57 150.45 42.59 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.916 ' HB2' HD13 ' B' ' 24' ' ' LEU . 36.8 t90 -146.87 137.02 23.49 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -123.86 142.32 39.15 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.5 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.1 159.08 48.45 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.379 2.053 . . . . 0.0 111.167 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.12 137.37 57.98 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.379 -179.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.8 29.81 75.84 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.333 -0.849 . . . . 0.0 113.192 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.495 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 19.1 mmtm -113.7 151.82 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.057 0.429 . . . . 0.0 110.936 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -99.82 -12.76 19.62 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.866 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -123.49 146.41 48.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.059 0.457 . . . . 0.0 111.571 -178.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -87.06 121.64 29.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.002 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.4 p -85.84 -23.65 27.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.34 0.59 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.571 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 16.4 mm -103.42 118.74 50.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.018 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 33.4 t -147.83 101.45 3.31 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.499 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 68.9 m-70 -124.67 132.03 53.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.221 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.528 ' O ' HG12 ' B' ' 50' ' ' ILE . 81.1 mmm -81.85 143.32 31.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.458 ' CE1' HD13 ' B' ' 99' ' ' LEU . 22.3 m-30 -56.97 -24.08 50.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 110.608 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.22 -27.55 64.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.992 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.592 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -93.35 -7.16 45.57 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.021 0.438 . . . . 0.0 110.683 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.628 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.0 mm -87.88 130.64 37.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.851 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 1.5 ttpt -87.52 -37.58 16.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.298 0.571 . . . . 0.0 109.817 -179.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.851 ' SG ' ' HE2' ' B' ' 51' ' ' LYS . 21.8 p -171.89 -178.13 2.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.78 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -143.33 140.77 30.7 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.262 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.042 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.8 mttp -107.04 156.17 19.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.509 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.6 OUTLIER -131.56 131.57 62.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 176.227 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.11 120.77 66.66 Favored Pre-proline 0 C--O 1.252 1.209 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.59 172.75 12.85 Favored 'Trans proline' 0 C--O 1.233 0.246 1 C-N-CA 125.319 4.013 . . . . 0.0 114.57 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -64.04 160.48 17.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.158 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.72 -29.03 8.08 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -178.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.899 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.6 mttp -86.96 160.36 18.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.9 -9.86 59.63 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.401 0.62 . . . . 0.0 109.658 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.613 ' HD3' ' HB3' ' A' ' 399' ' ' GLU . 3.7 ptmt -134.5 129.82 35.73 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.194 -179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.465 HG21 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -83.53 131.53 33.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 177.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.584 ' CG ' ' HE2' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -137.95 163.88 30.42 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -175.366 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.509 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.5 tp -139.63 153.46 47.33 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.046 -1.888 . . . . 0.0 106.842 176.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.042 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.3 138.02 24.81 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 119.254 0.934 . . . . 0.0 111.451 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.932 HD13 HD12 ' B' ' 31' ' ' ILE . 95.8 mt -94.01 100.54 12.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.923 179.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.666 ' HA ' HG23 ' B' ' 74' ' ' THR . 5.2 t -84.14 104.34 12.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.057 -0.719 . . . . 0.0 109.057 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.609 HD23 HD12 ' B' ' 50' ' ' ILE . 2.9 mt -91.36 158.67 16.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.913 0.387 . . . . 0.0 111.408 -178.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.592 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -81.25 -0.6 41.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.163 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.77 -9.29 58.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.582 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.08 9.7 56.85 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.0 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -126.4 151.58 47.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.927 0.394 . . . . 0.0 110.861 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.666 HG23 ' HA ' ' B' ' 68' ' ' VAL . 21.8 p -121.4 130.34 53.54 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.5 m -99.02 98.65 9.67 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -83.9 143.39 29.9 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.102 0.477 . . . . 0.0 111.28 -178.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.444 ' HZ ' HG22 ' B' ' 43' ' ' ILE . 65.2 m-85 -128.85 112.8 14.51 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.131 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.559 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.2 t-160 -86.55 104.75 16.29 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.639 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.715 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 52.2 m-85 -76.45 94.32 3.65 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 5.8 p -99.28 12.82 35.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.486 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 40.3 t30 -85.09 91.94 8.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -45.93 -32.38 2.68 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.836 0.854 . . . . 0.0 112.928 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.26 -60.64 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.512 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -128.63 11.88 6.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 -176.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.715 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -42.94 -50.31 5.83 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -52.32 60.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.868 0.366 . . . . 0.0 110.91 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.512 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.45 -35.68 80.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.9 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.668 ' O ' HG21 ' B' ' 92' ' ' VAL . 14.3 mt-10 -64.75 -44.31 90.52 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.509 ' HD2' HD11 ' B' ' 55' ' ' ILE . 20.6 ttp180 -56.18 -48.64 75.97 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.6 -43.83 96.99 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.588 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.4 -42.23 83.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 117.713 0.233 . . . . 0.0 111.178 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.81 HG11 HD12 ' B' ' 26' ' ' LEU . 38.2 t -62.23 -43.85 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.423 ' HB2' HD12 ' B' ' 65' ' ' LEU . 0.6 OUTLIER -57.9 -53.98 52.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.992 178.118 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.7 -54.54 45.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.868 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.877 ' HG ' HD11 ' B' ' 99' ' ' LEU . 13.7 tp -62.08 -35.7 79.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.355 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.427 HD11 HG12 ' B' ' 92' ' ' VAL . 28.3 mt -74.41 -47.37 34.24 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . 0.458 ' O ' ' HG3' ' B' ' 97' ' ' GLN . 0.0 OUTLIER -60.29 -21.59 62.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.278 1.037 . . . . 0.0 109.136 178.682 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -87.03 -45.49 10.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.171 -1.377 . . . . 0.0 111.482 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.877 HD11 ' HG ' ' B' ' 95' ' ' LEU . 10.6 mt -85.0 -43.81 13.64 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -176.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.628 HD22 ' HB ' ' B' ' 50' ' ' ILE . 22.7 mt -51.21 -60.51 5.56 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -176.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -59.72 -5.76 3.83 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.496 2.131 . . . . 0.0 114.177 -177.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -85.65 -20.89 28.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.852 0.358 . . . . 0.0 110.486 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.455 179.433 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.97 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.1 tt0 . . . . . 0 CA--C 1.514 -0.427 0 CA-C-O 120.738 0.304 . . . . 0.0 111.548 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.498 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 6.9 p-10 -136.53 91.67 2.68 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.511 0.672 . . . . 0.0 111.725 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.508 ' C ' ' H ' ' A' ' 403' ' ' PHE . 26.3 p-10 -139.16 -47.4 0.48 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -71.92 9.33 0.95 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.515 0.674 . . . . 0.0 110.592 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.748 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -52.03 118.3 3.37 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . 0.529 ' O ' ' HA ' ' B' ' 54' ' ' LYS . 1.0 OUTLIER . . . . . 0 C--N 1.319 -0.739 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.521 HG11 HG12 ' B' ' 11' ' ' ILE . 74.3 t . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 120.905 0.383 . . . . 0.0 110.493 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.6 mt -88.86 -32.17 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.433 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.518 ' HB3' ' HB2' ' B' ' 26' ' ' LEU . 6.1 tp -129.87 123.52 31.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.59 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.521 HG12 HG11 ' B' ' 8' ' ' VAL . 56.5 mt -107.97 120.9 60.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.856 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.2 t -112.13 149.99 14.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.614 ' O ' HG21 ' B' ' 15' ' ' VAL . 2.0 mtmp? -115.9 -179.78 3.75 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.705 -178.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 18.15 63.51 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 O-C-N 125.214 1.571 . . . . 0.0 113.937 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.614 HG21 ' O ' ' B' ' 13' ' ' LYS . 25.3 t -113.73 127.09 71.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.664 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 84.0 mtt180 -100.6 126.63 47.1 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.409 0.623 . . . . 0.0 111.619 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.479 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 5.6 tp-100 -105.84 103.39 12.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 0.6 OUTLIER 63.89 47.22 3.58 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.658 0.599 . . . . 0.0 110.16 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.418 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.4 OUTLIER 74.08 9.22 4.65 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.138 179.364 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.664 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.4 tp-100 -104.89 118.44 36.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.442 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 0.4 OUTLIER -72.11 147.5 46.63 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.328 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.557 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 178.29 -160.68 26.96 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.904 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.4 136.21 50.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.951 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.32 139.11 33.76 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.298 -179.016 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . 0.407 ' CE1' HG22 ' B' ' 11' ' ' ILE . 75.7 m-85 -132.63 109.59 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.389 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 1.001 HD11 HG13 ' B' ' 92' ' ' VAL . 9.0 mt -87.46 125.22 34.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.836 0.35 . . . . 0.0 110.892 -179.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 41.6 mtt -103.73 164.02 11.95 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.98 -39.18 71.45 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . 0.941 ' HA ' ' HZ ' ' B' ' 103' ' ' PHE . 25.9 mm-40 -113.02 1.49 15.38 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . 0.442 ' NH1' ' HB2' ' B' ' 29' ' ' GLU . 0.0 OUTLIER -161.76 154.61 20.43 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 119.522 -0.871 . . . . 0.0 112.76 -178.064 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.667 HD13 HD11 ' B' ' 67' ' ' LEU . 1.2 tt -102.81 118.13 49.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.56 152.2 36.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.398 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.951 ' HB2' HD11 ' B' ' 24' ' ' LEU . 38.1 t90 -147.09 134.71 21.01 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.459 ' HB2' ' CD2' ' B' ' 41' ' ' PHE . . . -120.96 129.61 25.22 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.78 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.631 ' HG2' ' HD3' ' B' ' 38' ' ' LYS . 47.4 Cg_endo -73.55 143.71 34.77 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.498 2.132 . . . . 0.0 111.7 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.557 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 63.2 mt-10 -61.64 131.2 49.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 0.0 110.856 -179.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.65 -10.62 60.96 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.834 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.631 ' HD3' ' HG2' ' B' ' 35' ' ' PRO . 5.8 mptt -113.65 152.51 30.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -100.9 -18.5 16.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.68 127.91 53.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.008 0.432 . . . . 0.0 111.816 -178.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.459 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 44.6 m-85 -63.95 121.09 13.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.56 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.38 -34.23 23.62 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.984 0.421 . . . . 0.0 110.843 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.83 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 24.2 mm -93.43 122.69 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.909 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 35.8 t -147.95 101.2 3.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.407 ' CD2' HG22 ' B' ' 43' ' ' ILE . 79.9 m-70 -127.43 140.51 52.12 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.486 ' O ' HG12 ' B' ' 50' ' ' ILE . 27.8 mtp -91.82 144.88 25.04 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.761 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.5 m-30 -60.29 -19.8 56.49 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.838 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.92 -21.53 63.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.379 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.545 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -101.51 -11.28 19.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.001 0.429 . . . . 0.0 110.6 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.807 ' HB ' HD21 ' B' ' 100' ' ' LEU . 1.5 mm -88.68 125.89 41.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.628 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 9.3 tmtt? -86.18 -38.04 18.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.03 0.443 . . . . 0.0 109.919 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.628 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 28.3 p -169.55 -177.81 2.86 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.402 -0.817 . . . . 0.0 108.917 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.11 141.94 46.12 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.751 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.09 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 26.9 mttp -102.62 146.7 27.79 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.534 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.77 126.82 69.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.174 -1.046 . . . . 0.0 108.174 177.247 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' SER . . . . . 0.447 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.56 118.5 69.09 Favored Pre-proline 0 C--O 1.249 1.062 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.76 173.03 10.65 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 125.079 3.853 . . . . 0.0 114.624 -177.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -61.69 160.51 11.5 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.395 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.02 8.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 109.606 -1.397 . . . . 0.0 109.606 -177.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.97 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 12.8 mttp -87.75 152.66 21.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.06 -11.11 60.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.212 0.529 . . . . 0.0 110.544 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.451 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.95 138.0 35.21 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.661 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.509 HG22 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -83.3 140.55 16.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 177.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.447 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 17.4 mt-30 -139.98 162.86 34.19 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 118.529 -1.269 . . . . 0.0 114.081 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -142.38 153.81 44.09 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.58 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.09 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.37 144.83 30.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 118.978 0.808 . . . . 0.0 110.328 178.025 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.667 HD11 HD13 ' B' ' 31' ' ' ILE . 96.7 mt -94.06 104.51 16.54 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.229 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.603 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 45.0 t -88.92 120.36 37.5 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.478 HD11 ' HB3' ' B' ' 73' ' ' ASP . 9.4 mt -101.93 151.78 21.71 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.112 0.482 . . . . 0.0 111.791 -177.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.545 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.2 -7.55 54.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.611 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.3 -4.79 46.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.425 -1.262 . . . . 0.0 110.875 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.73 21.53 46.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . 0.478 ' HB3' HD11 ' B' ' 69' ' ' LEU . 20.1 t70 -126.02 160.92 28.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.446 -0.377 . . . . 0.0 110.222 -179.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.573 HG22 ' HA ' ' B' ' 68' ' ' VAL . 12.0 p -142.68 131.48 22.79 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 19.9 m -110.77 107.07 16.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.266 0.226 . . . . 0.0 110.434 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.29 151.18 26.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.517 . . . . 0.0 112.318 -178.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.83 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 35.9 m-85 -134.93 115.53 13.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.606 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.605 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.0 t-160 -87.35 100.91 13.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.887 -179.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.673 ' HB3' ' HB3' ' B' ' 85' ' ' ALA . 22.9 m-85 -77.12 102.13 6.43 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.76 22.19 15.67 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.862 0.689 . . . . 0.0 112.862 -178.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.425 HD21 ' HA ' ' B' ' 81' ' ' ASN . 1.2 t-20 -89.45 97.06 10.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 110.292 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.09 -30.29 2.68 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.42 -59.53 2.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -178.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.5 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.0 p -127.38 11.05 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -175.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.673 ' HB3' ' HB3' ' B' ' 79' ' ' PHE . . . -45.63 -45.67 14.06 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.477 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.3 t -59.88 -52.67 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.803 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.5 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -67.52 -34.52 77.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.038 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.662 ' O ' HG21 ' B' ' 92' ' ' VAL . 11.1 mt-10 -65.06 -45.61 84.59 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.534 ' HD2' ' HB ' ' B' ' 55' ' ' ILE . 24.7 ttp180 -54.06 -47.79 71.27 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 122.21 1.005 . . . . 0.0 108.398 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.27 -44.98 93.59 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.514 -1.675 . . . . 0.0 112.6 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.67 90.91 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.74 0.245 . . . . 0.0 111.154 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 1.001 HG13 HD11 ' B' ' 26' ' ' LEU . 42.9 t -60.87 -44.89 98.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -57.93 -54.65 44.51 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.063 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 1.6 m-20 -55.37 -52.16 64.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.494 -1.23 . . . . 0.0 112.525 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.814 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -65.23 -28.42 69.35 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.822 -178.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 35.5 mt -78.47 -45.74 21.38 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.377 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' B' ' 94' ' ' ASP . 24.7 pt20 -63.14 -18.24 63.22 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.249 1.023 . . . . 0.0 109.156 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -88.47 -47.96 7.96 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.927 -1.488 . . . . 0.0 111.057 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.814 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -83.62 -41.31 17.97 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.807 HD21 ' HB ' ' B' ' 50' ' ' ILE . 35.7 mt -51.96 -50.85 76.01 Favored Pre-proline 0 CA--C 1.54 0.596 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 21.6 Cg_exo -66.08 -23.09 53.82 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.182 1.921 . . . . 0.0 115.146 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 11.0 pttp -72.49 1.81 7.41 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.941 -0.475 . . . . 0.0 112.096 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.941 ' HZ ' ' HA ' ' B' ' 29' ' ' GLU . 30.2 m-85 . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.384 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.523 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 3.8 pt-20 . . . . . 0 CA--C 1.515 -0.401 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.765 ' HB3' HD22 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -132.77 83.91 2.1 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.758 -178.612 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.533 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.7 p-10 -138.23 -47.37 0.52 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -73.81 12.28 0.7 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.513 0.673 . . . . 0.0 110.442 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.775 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -53.78 122.13 9.31 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.884 179.44 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.502 -0.898 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.0 mt -96.0 -30.39 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.092 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.465 HD22 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -132.92 122.73 24.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 80.3 mt -109.13 118.36 56.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.714 HG11 ' HE2' ' B' ' 79' ' ' PHE . 2.6 t -112.22 147.79 15.77 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.641 ' O ' HG21 ' B' ' 15' ' ' VAL . 1.0 OUTLIER -109.22 -177.65 3.35 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 18.97 74.29 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 O-C-N 125.388 1.68 . . . . 0.0 112.883 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.641 HG21 ' O ' ' B' ' 13' ' ' LYS . 39.8 t -124.44 122.59 64.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.314 179.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.611 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 7.3 mtp180 -96.25 130.98 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.353 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.602 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 0.7 OUTLIER -121.42 103.38 8.9 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.612 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp 59.15 64.89 1.29 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.179 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 68.93 22.89 6.9 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 176.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.644 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.9 pt20 -145.69 132.64 20.21 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.995 0.816 . . . . 0.0 110.858 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -86.23 153.76 21.78 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.07 -156.34 17.09 Favored Glycine 0 CA--C 1.522 0.516 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.756 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.31 135.11 54.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.856 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -100.69 140.85 34.38 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.481 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -135.96 109.83 8.17 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.817 0.342 . . . . 0.0 110.236 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.955 HD11 HG13 ' B' ' 92' ' ' VAL . 10.6 mt -89.0 120.84 30.78 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.53 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 36.5 mtt -102.24 161.56 13.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.043 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -28.82 57.86 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.927 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.92 -16.9 13.43 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ptp85 -158.91 162.01 36.84 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.796 -0.761 . . . . 0.0 112.822 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.889 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.07 114.81 41.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.741 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.466 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -113.56 150.36 33.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.976 0.417 . . . . 0.0 110.836 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.856 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.9 t90 -147.56 141.71 26.11 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.007 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -128.6 136.94 29.9 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.257 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.653 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 20.0 Cg_exo -64.75 158.22 51.83 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.566 2.177 . . . . 0.0 112.104 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -56.17 121.61 9.85 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.413 0.625 . . . . 0.0 112.099 -178.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.05 29.77 68.53 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.266 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.653 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.64 136.47 52.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.034 0.417 . . . . 0.0 110.358 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.4 -16.51 42.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.372 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -109.64 138.21 46.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.689 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -82.97 120.39 25.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.3 p -96.88 -6.49 35.71 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.089 0.471 . . . . 0.0 110.957 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.605 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 11.1 mm -119.88 117.32 53.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.079 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.6 t -147.9 101.33 3.29 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.43 ' CD2' HG22 ' B' ' 43' ' ' ILE . 69.9 m-70 -122.13 128.99 51.94 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.461 ' O ' HG12 ' B' ' 50' ' ' ILE . 65.4 mmm -80.04 141.11 36.18 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.582 ' HB3' HD23 ' B' ' 100' ' ' LEU . 23.1 m-85 -56.15 -24.77 43.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.941 0.4 . . . . 0.0 110.95 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.65 -29.18 65.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.121 -179.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.621 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -89.8 -4.82 57.44 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.188 0.518 . . . . 0.0 110.592 -179.041 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.507 ' HB ' HD21 ' B' ' 100' ' ' LEU . 4.4 mm -88.34 128.86 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.39 -43.73 13.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.6 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 6.7 p -161.6 -177.82 6.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.733 -178.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -142.22 143.59 32.96 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.963 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.046 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 27.6 mttp -112.92 153.44 27.98 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.578 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.7 OUTLIER -132.2 125.48 54.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.691 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -89.41 115.53 64.0 Favored Pre-proline 0 C--O 1.249 1.051 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.28 172.57 7.42 Favored 'Trans proline' 0 CA--C 1.518 -0.297 0 C-N-CA 125.155 3.903 . . . . 0.0 114.68 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.68 158.87 17.35 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.441 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.58 -29.16 8.04 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 109.841 -1.303 . . . . 0.0 109.841 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 4.2 mttm -82.36 156.26 24.32 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 176.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.19 -18.5 61.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.64 0.733 . . . . 0.0 109.271 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.41 119.63 18.81 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.104 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.518 HG12 HG21 ' B' ' 86' ' ' VAL . 3.1 mp -72.74 134.57 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -137.5 163.32 31.43 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.468 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -138.11 153.15 49.28 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 175.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.046 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -144.96 138.49 26.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 119.505 1.048 . . . . 0.0 111.478 179.043 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.889 HD11 HD13 ' B' ' 31' ' ' ILE . 94.7 mt -94.21 105.96 17.94 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.853 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.6 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -91.54 111.78 24.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.462 HD21 HD13 ' B' ' 50' ' ' ILE . 2.3 mt -100.34 158.65 15.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -176.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.621 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -77.49 -6.98 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.208 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.87 -7.79 52.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.727 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.4 15.04 57.81 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.814 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -126.22 155.46 41.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.996 0.427 . . . . 0.0 110.954 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.529 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 24.3 p -129.96 131.46 45.96 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.009 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.542 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 4.3 m -105.82 105.08 14.95 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.485 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . 0.765 HD22 ' HB3' ' A' ' 400' ' ' ASP . 4.6 m-20 -82.09 137.65 34.98 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.548 0.689 . . . . 0.0 111.811 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.605 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.3 m-85 -125.57 102.5 7.4 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 114.653 -1.158 . . . . 0.0 108.724 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.611 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.4 t-160 -86.84 117.13 25.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.206 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.714 ' HE2' HG11 ' B' ' 12' ' ' VAL . 70.7 m-85 -83.28 94.84 8.0 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.46 1.05 54.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.528 ' O ' ' HB1' ' B' ' 85' ' ' ALA . 0.2 OUTLIER -78.17 91.08 4.3 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.038 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.57 -35.4 3.94 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 19.3 m -60.7 -60.71 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 17.9 p -128.23 15.73 6.69 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.535 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -43.68 -46.3 7.36 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.6 HG13 ' HD2' ' B' ' 87' ' ' LYS . 24.3 t -58.32 -53.09 51.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 0.0 111.574 -179.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.6 ' HD2' HG13 ' B' ' 86' ' ' VAL . 0.0 OUTLIER -75.7 -25.15 56.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.623 -178.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.608 ' O ' HG22 ' B' ' 92' ' ' VAL . 16.0 mt-10 -67.26 -40.32 86.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 176.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.522 ' NE ' HD12 ' B' ' 55' ' ' ILE . 18.5 ttp180 -59.44 -45.89 90.29 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . 0.583 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 83.6 m-20 -58.69 -48.34 81.42 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.78 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.09 -42.03 94.45 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.955 HG13 HD11 ' B' ' 26' ' ' LEU . 60.9 t -62.02 -43.39 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.583 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 11.1 ttpp -58.92 -51.93 67.93 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.942 177.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -58.75 -54.31 48.5 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.889 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.732 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.5 tp -59.61 -38.85 82.37 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.705 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.76 -42.67 70.15 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.7 -24.3 67.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 122.383 1.087 . . . . 0.0 109.008 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -85.9 -47.94 9.19 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.934 -1.485 . . . . 0.0 111.425 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.732 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -80.78 -43.02 20.79 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 115.189 1.552 . . . . 0.0 115.189 -176.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.623 ' HB2' ' HD3' ' B' ' 101' ' ' PRO . 24.7 mt -51.14 -59.89 6.76 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.623 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 29.6 Cg_exo -62.73 -16.07 50.75 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.012 1.808 . . . . 0.0 113.251 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.5 mtmm -78.69 -15.56 58.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 110.281 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 . . . . . 0 C--N 1.327 -0.402 0 CA-C-O 121.476 0.655 . . . . 0.0 109.548 179.177 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.556 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.515 -0.373 0 CA-C-O 120.788 0.327 . . . . 0.0 110.572 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.442 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 0.6 OUTLIER -141.14 83.27 1.87 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.267 -179.345 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.582 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.2 p-10 -138.25 -46.67 0.52 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . 0.405 ' OD1' ' HG3' ' B' ' 60' ' ' LYS . 2.3 p30 -72.97 11.58 0.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 122.047 0.927 . . . . 0.0 110.017 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.863 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -60.51 115.77 3.83 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.514 179.062 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 116.741 -0.208 . . . . 0.0 111.554 -178.532 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.548 HG22 ' HE3' ' B' ' 27' ' ' MET . 62.9 t . . . . . 0 CA--C 1.516 -0.331 0 CA-C-O 121.094 0.473 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 27.9 mt -97.48 -31.83 12.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.93 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.2 tp -129.27 120.0 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.866 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.407 HG23 ' CE2' ' B' ' 25' ' ' TYR . 70.0 mt -103.9 120.93 54.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.939 -0.764 . . . . 0.0 108.939 177.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.801 HG21 HD23 ' B' ' 24' ' ' LEU . 3.3 t -111.27 149.31 14.06 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.383 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.602 ' O ' HG21 ' B' ' 15' ' ' VAL . 1.5 mtmp? -113.86 179.32 3.99 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.543 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.494 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.48 72.04 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 O-C-N 125.328 1.642 . . . . 0.0 113.22 -178.155 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.602 HG21 ' O ' ' B' ' 13' ' ' LYS . 47.6 t -117.32 124.4 72.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.907 -1.042 . . . . 0.0 108.969 178.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.609 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.2 mtp180 -97.02 129.19 44.51 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.383 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.29 103.64 8.34 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.885 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.98 45.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.243 0 O-C-N 123.767 0.667 . . . . 0.0 110.65 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.411 ' HA ' ' CZ ' ' B' ' 16' ' ' ARG . 0.0 OUTLIER 67.13 23.4 9.58 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.792 179.59 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.589 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 2.9 tp-100 -123.67 119.43 29.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.605 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.78 153.32 27.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.189 0.519 . . . . 0.0 112.349 -177.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.02 -154.49 13.02 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.602 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.45 132.1 48.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.891 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.49 141.69 30.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . 0.407 ' CE2' HG23 ' B' ' 11' ' ' ILE . 37.4 m-85 -135.23 120.33 18.79 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.938 HD13 HG13 ' B' ' 92' ' ' VAL . 14.5 mt -99.94 116.24 31.53 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.03 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.555 ' HE2' ' HB2' ' B' ' 32' ' ' ALA . 2.8 mpt? -92.92 163.48 13.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.657 178.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.78 -39.9 62.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 58.5 mp0 -110.48 -5.04 15.23 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' B' ' 30' ' ' ARG . 14.4 ptt-85 -161.09 158.76 28.23 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.394 -0.922 . . . . 0.0 112.587 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.897 HD11 HD13 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.83 128.98 59.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.126 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.555 ' HB2' ' HE2' ' B' ' 27' ' ' MET . . . -129.91 153.6 48.17 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.9 0.381 . . . . 0.0 110.509 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.891 ' HB2' HD12 ' B' ' 24' ' ' LEU . 36.5 t90 -147.01 141.8 26.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.425 ' HB3' ' HA ' ' B' ' 41' ' ' PHE . . . -128.25 143.91 49.81 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.866 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' B' ' 34' ' ' ALA . 17.3 Cg_exo -65.48 153.01 80.14 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.699 2.266 . . . . 0.0 111.354 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -65.32 116.11 6.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.963 0.411 . . . . 0.0 110.21 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.25 8.75 54.75 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.301 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.894 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -105.04 144.8 31.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.689 0.757 . . . . 0.0 111.57 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.02 -22.31 27.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.172 -1.376 . . . . 0.0 111.523 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -122.13 150.29 42.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 0.0 111.611 -178.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.425 ' HA ' ' HB3' ' B' ' 34' ' ' ALA . 16.0 m-85 -79.9 143.4 34.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.17 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.1 -25.31 13.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.141 0.496 . . . . 0.0 110.476 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.829 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 16.3 mm -104.01 124.95 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.385 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.6 t -148.14 101.73 3.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.49 ' CD2' HG21 ' B' ' 43' ' ' ILE . 60.2 m-70 -130.25 138.43 50.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.52 ' O ' HG12 ' B' ' 50' ' ' ILE . 30.6 mtp -90.83 145.28 24.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.629 ' HB3' HD21 ' B' ' 100' ' ' LEU . 22.0 m-85 -57.84 -24.1 55.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.667 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.63 -26.2 64.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.876 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.558 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.96 -7.48 36.41 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.993 0.425 . . . . 0.0 110.735 -179.436 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.625 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -86.9 127.44 40.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.427 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 0.2 OUTLIER -81.38 -40.38 23.57 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.178 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.528 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 31.8 p -173.28 -177.84 1.6 Allowed 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.459 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . 0.506 HE22 HD13 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -137.71 139.34 40.11 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.909 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.065 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -102.76 151.4 22.44 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.566 HG23 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -128.03 128.98 69.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 175.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -90.05 114.08 59.56 Favored Pre-proline 0 C--O 1.249 1.068 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -68.67 172.94 10.71 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 125.103 3.869 . . . . 0.0 114.492 -177.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -58.98 157.86 9.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.035 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.32 -29.03 8.21 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.556 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 4.1 mttm -85.28 160.09 19.92 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.1 -13.35 59.35 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.688 ' HB3' ' CD2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -131.72 127.75 37.49 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.568 -179.329 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.59 HG21 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -78.11 125.0 37.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 176.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -133.44 163.58 29.05 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -175.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.598 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -140.56 153.32 46.08 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 113.659 -1.609 . . . . 0.0 107.52 176.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.065 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.62 145.48 30.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 119.273 0.942 . . . . 0.0 111.141 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.897 HD13 HD11 ' B' ' 31' ' ' ILE . 73.1 mt -96.27 106.22 18.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.026 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.569 ' HA ' HG21 ' B' ' 74' ' ' THR . 10.6 t -93.25 121.87 44.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 mt -108.36 154.35 21.96 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -177.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.558 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.34 -5.73 46.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.747 0.784 . . . . 0.0 108.94 178.274 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.43 -4.11 43.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.559 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.57 21.04 55.19 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.371 -0.692 . . . . 0.0 111.371 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.05 157.3 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.514 -0.343 . . . . 0.0 110.533 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.569 HG21 ' HA ' ' B' ' 68' ' ' VAL . 19.8 p -139.86 131.03 26.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.546 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.3 102.68 11.78 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.464 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -82.36 139.14 34.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.338 0.589 . . . . 0.0 111.637 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.829 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 53.5 m-85 -129.53 110.92 12.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.012 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.688 ' CD2' ' HB3' ' B' ' 62' ' ' LYS . 5.3 t-160 -87.51 121.24 29.7 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.01 179.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.771 ' HB3' ' HB2' ' B' ' 85' ' ' ALA . 42.4 m-85 -85.03 93.6 8.63 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.5 13.68 25.22 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.494 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.0 OUTLIER -86.08 94.27 9.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.316 0.579 . . . . 0.0 110.513 179.47 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.74 -31.05 1.81 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -178.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.05 -59.52 2.7 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -178.191 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.512 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.3 p -127.32 14.16 7.16 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -176.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.771 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -45.36 -49.66 12.83 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.404 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.14 -51.4 73.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 110.876 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.512 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.6 mttt -66.38 -34.53 78.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.054 0.454 . . . . 0.0 109.979 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.599 ' O ' HG22 ' B' ' 92' ' ' VAL . 12.0 mt-10 -65.84 -44.81 84.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.59 ' HD3' HG21 ' B' ' 63' ' ' ILE . 23.1 ttp180 -55.61 -45.33 77.51 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . 0.688 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -63.56 -45.79 88.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.733 -1.576 . . . . 0.0 112.519 179.676 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.22 81.85 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.924 0.329 . . . . 0.0 111.421 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.938 HG13 HD13 ' B' ' 26' ' ' LEU . 45.3 t -62.79 -39.38 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.688 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.6 OUTLIER -62.17 -56.89 14.18 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.563 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.09 -53.89 46.93 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.801 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.788 ' HG ' HD13 ' B' ' 99' ' ' LEU . 13.1 tp -61.64 -39.42 91.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.202 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.7 mt -69.47 -45.17 69.63 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 117.946 0.339 . . . . 0.0 110.366 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -64.24 -18.63 64.73 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.851 0.834 . . . . 0.0 109.475 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -85.88 -51.36 6.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.901 178.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.788 HD13 ' HG ' ' B' ' 95' ' ' LEU . 15.2 mt -76.0 -46.76 27.85 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.415 -1.721 . . . . 0.0 115.361 -176.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.629 HD21 ' HB3' ' B' ' 47' ' ' TYR . 31.5 mt -50.39 -60.15 5.85 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -61.74 -14.48 36.47 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.008 1.805 . . . . 0.0 113.146 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 20.3 mtmm -86.97 -14.51 41.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.17 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 . . . . . 0 C--N 1.331 -0.218 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.47 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.957 ' HG2' ' HE2' ' B' ' 62' ' ' LYS . 3.9 pt-20 . . . . . 0 CA--C 1.518 -0.276 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.841 ' HB3' HD22 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -143.55 84.53 1.8 Allowed 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.132 -0.627 . . . . 0.0 112.537 -177.244 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.535 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.7 p-10 -139.15 -45.67 0.47 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -72.37 11.06 0.65 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 110.271 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.869 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.02 112.55 1.55 Allowed 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.414 179.24 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 . . . . . 0 C--N 1.32 -0.71 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.411 -177.856 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 88.5 t . . . . . 0 CA--C 1.516 -0.336 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.535 HD12 HD12 ' B' ' 99' ' ' LEU . 22.7 mt -95.29 -29.01 14.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.264 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.444 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -137.4 137.3 38.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.055 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 75.5 mt -122.85 115.96 47.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.681 HG21 HD22 ' B' ' 24' ' ' LEU . 3.0 t -104.93 149.25 8.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.09 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.532 ' O ' HG22 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.08 173.21 6.42 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.57 -179.177 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.576 ' HE3' ' HA ' ' B' ' 81' ' ' ASN . 22.1 mtmt 18.23 82.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 125.341 1.651 . . . . 0.0 113.471 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.532 HG22 ' O ' ' B' ' 13' ' ' LYS . 31.6 t -129.02 123.6 59.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.186 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.612 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 6.8 mtp-105 -98.61 141.27 31.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.213 0.53 . . . . 0.0 112.22 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -132.5 103.43 6.17 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 177.096 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 59.4 mttp 65.09 56.54 1.02 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.026 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? 68.83 23.93 6.69 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.155 177.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.562 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 10.4 tt0 -135.83 119.72 17.41 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.65 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -81.94 153.15 26.42 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.821 0.344 . . . . 0.0 111.72 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.614 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -177.38 -158.36 20.33 Favored Glycine 0 CA--C 1.521 0.433 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.186 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.42 136.83 54.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.126 0.488 . . . . 0.0 110.648 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.936 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.3 139.7 35.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.128 -178.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.45 125.72 29.63 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.86 HD11 HG11 ' B' ' 92' ' ' VAL . 16.9 mt -107.94 117.34 33.87 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.476 -0.489 . . . . 0.0 111.128 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.494 ' HE3' ' HB2' ' B' ' 32' ' ' ALA . 2.2 mpt? -97.49 159.68 14.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.14 -27.83 55.64 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.101 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . 0.976 ' HA ' ' HE2' ' B' ' 103' ' ' PHE . 0.9 OUTLIER -103.07 -25.12 13.53 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.13 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . 0.477 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -157.97 169.86 23.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.915 -175.989 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.891 HD13 HD13 ' B' ' 67' ' ' LEU . 1.5 tt -110.79 122.14 64.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.661 178.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.494 ' HB2' ' HE3' ' B' ' 27' ' ' MET . . . -123.17 149.82 44.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.011 0.434 . . . . 0.0 110.599 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.936 ' HB2' HD12 ' B' ' 24' ' ' LEU . 39.7 t90 -146.68 134.07 20.75 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -122.92 131.46 24.36 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.334 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.614 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 9.3 Cg_exo -70.3 160.0 51.08 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.536 2.157 . . . . 0.0 111.353 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 145.26 55.78 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.918 0.39 . . . . 0.0 109.972 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.35 24.87 74.93 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.555 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' B' ' 38' ' ' LYS . 25.3 mmtm -114.19 153.36 29.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.587 0.232 . . . . 0.0 110.579 179.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -106.39 5.02 29.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.556 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -151.73 160.18 43.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.24 -179.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -86.1 125.71 33.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.083 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 3.0 p -90.64 -22.48 21.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.29 0.567 . . . . 0.0 110.328 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.635 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 17.8 mm -107.46 118.62 55.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.111 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -147.93 101.58 3.31 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 59.1 m-70 -127.74 134.87 49.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.281 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.488 ' O ' HG12 ' B' ' 50' ' ' ILE . 84.0 mmm -84.79 143.07 29.35 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.705 ' HB2' ' HD2' ' B' ' 103' ' ' PHE . 22.7 m-30 -57.28 -22.69 43.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.83 0.348 . . . . 0.0 111.294 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.19 -26.87 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.893 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.64 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.6 OUTLIER -94.28 -4.21 49.19 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 110.6 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.578 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.7 mm -90.35 128.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -85.43 -40.68 16.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.396 0.617 . . . . 0.0 109.452 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.581 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.8 p -168.59 -177.62 3.18 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.291 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -143.06 139.57 30.56 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.313 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.941 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 53.2 mttp -106.99 161.44 14.72 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.649 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -133.07 130.15 57.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 175.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' SER . . . . . 0.528 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -91.27 118.0 68.2 Favored Pre-proline 0 C--O 1.25 1.086 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.66 173.08 11.4 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 124.966 3.778 . . . . 0.0 114.011 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -59.95 160.84 7.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.161 178.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.23 -28.76 8.09 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -177.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.569 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 14.5 mttp -89.52 158.29 17.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 176.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.96 -5.71 42.95 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.241 0.543 . . . . 0.0 110.485 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.957 ' HE2' ' HG2' ' A' ' 399' ' ' GLU . 0.7 OUTLIER -142.78 146.69 34.49 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.049 -179.558 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.661 HG21 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -90.61 131.47 37.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.528 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 24.5 mt-30 -131.9 163.16 28.93 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.511 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -140.82 153.45 45.8 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.417 -1.719 . . . . 0.0 106.642 175.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 0.941 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.47 142.39 28.05 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 119.149 0.886 . . . . 0.0 111.875 179.135 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.891 HD13 HD13 ' B' ' 31' ' ' ILE . 89.6 mt -94.33 104.49 16.47 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.928 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.634 ' HA ' HG23 ' B' ' 74' ' ' THR . 4.1 t -90.14 114.39 27.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.533 HD23 HD13 ' B' ' 50' ' ' ILE . 4.0 mt -100.75 155.64 17.8 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -177.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.64 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -77.69 -3.46 41.23 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.279 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.94 -7.33 56.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.259 179.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.04 17.59 50.49 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.866 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -126.25 160.29 30.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.698 0.285 . . . . 0.0 110.8 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.634 HG23 ' HA ' ' B' ' 68' ' ' VAL . 21.2 p -137.71 131.73 31.79 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.55 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.4 m -106.48 109.57 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.41 0.148 . . . . 0.0 111.302 -179.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . 0.841 HD22 ' HB3' ' A' ' 400' ' ' ASP . 5.6 m-20 -82.29 147.29 28.97 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.742 0.782 . . . . 0.0 112.19 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.635 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 43.1 m-85 -134.51 103.5 5.71 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.743 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.612 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.6 t-160 -86.46 107.78 18.22 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.513 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.67 ' CE2' HG11 ' B' ' 12' ' ' VAL . 54.2 m-85 -76.26 94.37 3.55 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.158 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.04 5.16 47.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.891 -178.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.576 ' HA ' ' HE3' ' B' ' 14' ' ' LYS . 46.4 t30 -85.98 91.13 8.29 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . 0.509 ' CD ' ' HZ1' ' B' ' 14' ' ' LYS . 0.7 OUTLIER -51.66 -29.09 16.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.543 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 2.1 m -60.13 -60.21 4.18 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.51 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.9 p -128.34 12.76 6.54 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.652 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -43.7 -50.04 7.68 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.42 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -58.34 -52.44 59.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.848 0.356 . . . . 0.0 110.869 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.51 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.4 mttt -66.4 -37.33 84.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.052 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.677 ' O ' HG21 ' B' ' 92' ' ' VAL . 13.8 mt-10 -63.95 -43.55 95.49 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.661 ' HD3' HG21 ' B' ' 63' ' ' ILE . 28.4 ttp180 -56.63 -49.67 74.29 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . 0.517 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -59.85 -43.3 94.7 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.635 -1.62 . . . . 0.0 112.225 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -43.47 74.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.675 0.216 . . . . 0.0 111.27 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.86 HG11 HD11 ' B' ' 26' ' ' LEU . 40.2 t -61.02 -42.72 94.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.649 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.3 tmmt? -59.34 -58.66 7.65 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.722 178.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.31 -53.91 44.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.158 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.542 ' HG ' ' CD1' ' B' ' 99' ' ' LEU . 10.7 tp -62.12 -37.13 83.95 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.182 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.45 HD12 HG12 ' B' ' 92' ' ' VAL . 26.0 mt -73.34 -41.01 63.97 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.7 -19.96 59.93 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.197 0.998 . . . . 0.0 108.971 178.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -93.86 -51.9 4.68 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.813 -1.54 . . . . 0.0 111.043 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.645 ' HB3' ' CE1' ' B' ' 47' ' ' TYR . 42.4 mt -75.75 -28.41 58.48 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.494 -1.685 . . . . 0.0 115.432 -176.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.578 HD22 ' HB ' ' B' ' 50' ' ' ILE . 36.4 mt -72.5 -58.18 3.08 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 18.6 Cg_endo -57.59 -19.18 35.98 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.542 2.162 . . . . 0.0 114.178 -177.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.575 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 17.9 pttm -80.5 -11.98 59.6 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.172 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.976 ' HE2' ' HA ' ' B' ' 29' ' ' GLU . 17.5 m-30 . . . . . 0 N--CA 1.466 0.357 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.772 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.885 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 57.7 tt0 . . . . . 0 CA--C 1.514 -0.421 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.547 ' HB3' HD22 ' B' ' 76' ' ' ASN . 0.2 OUTLIER -135.94 91.27 2.67 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.484 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.09 -45.22 0.47 Allowed 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -72.05 8.22 1.35 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.269 0.557 . . . . 0.0 110.774 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.937 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -52.99 120.05 5.39 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.75 179.426 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.352 -178.026 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t . . . . . 0 N--CA 1.451 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.3 mt -95.67 -31.66 13.14 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.301 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.449 HD21 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -131.37 129.3 41.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.923 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.421 HG21 ' CE1' ' B' ' 25' ' ' TYR . 73.1 mt -113.82 122.68 68.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.841 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.6 t -113.59 150.27 15.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.629 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.7 mtmp? -116.67 178.6 4.28 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.441 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.486 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 1.2 mmtm 18.45 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 O-C-N 125.2 1.562 . . . . 0.0 113.422 -178.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.629 HG23 ' O ' ' B' ' 13' ' ' LYS . 24.7 t -124.01 125.11 70.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.139 179.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.62 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.8 mpt_? -93.75 132.78 37.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.92 0.39 . . . . 0.0 110.629 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.409 ' HG3' HG13 ' B' ' 43' ' ' ILE . 5.2 tm0? -129.59 113.74 15.19 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.474 ' HD3' ' HA ' ' B' ' 18' ' ' LYS . 0.5 OUTLIER 66.4 41.03 3.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.952 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? 68.52 29.94 5.4 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.051 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.585 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.6 tp-100 -131.23 126.64 36.02 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.525 ' HA ' ' HG3' ' B' ' 16' ' ' ARG . 9.3 t0 -73.95 146.57 43.8 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.59 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -179.1 -164.69 32.18 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.656 -0.783 . . . . 0.0 113.84 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.46 136.6 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.182 0.593 . . . . 0.0 109.43 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.842 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -99.13 143.64 29.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.993 -178.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . 0.421 ' CE1' HG21 ' B' ' 11' ' ' ILE . 34.3 m-85 -137.57 115.56 11.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.82 0.343 . . . . 0.0 110.173 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.875 HD11 HG13 ' B' ' 92' ' ' VAL . 13.0 mt -94.25 128.41 40.69 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.772 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 18.8 mtt -106.44 167.98 9.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.775 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.87 65.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -176.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -121.67 4.31 10.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . 0.445 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.2 OUTLIER -157.84 156.59 31.71 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 119.29 -0.964 . . . . 0.0 112.68 -177.931 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.958 HD11 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -109.08 120.86 61.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 108.592 178.449 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.433 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.04 150.57 40.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.495 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.842 ' HB2' HD11 ' B' ' 24' ' ' LEU . 29.7 t90 -147.12 135.53 21.79 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.422 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -123.74 134.41 25.29 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.137 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 1.03 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -72.48 144.93 41.47 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 122.314 2.01 . . . . 0.0 111.591 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.454 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 32.2 mt-10 -64.45 129.24 39.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.157 0.503 . . . . 0.0 110.648 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.5 1.38 64.17 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.05 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 1.03 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.0 mptt -113.34 151.64 30.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.632 0.253 . . . . 0.0 110.327 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -100.15 8.09 44.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.887 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -138.97 151.67 47.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.131 0.491 . . . . 0.0 112.077 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -86.0 121.36 28.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.585 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -16.12 29.24 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.232 0.539 . . . . 0.0 110.529 179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.658 HG22 ' HZ ' ' B' ' 77' ' ' PHE . 18.9 mm -113.65 118.91 59.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.752 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.3 t -148.03 101.21 3.27 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.471 ' CD2' HG23 ' B' ' 43' ' ' ILE . 54.5 m-70 -128.12 138.58 52.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.528 ' O ' HG12 ' B' ' 50' ' ' ILE . 61.6 mmm -88.33 143.64 26.89 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.739 ' HB3' HD22 ' B' ' 100' ' ' LEU . 22.2 m-85 -59.84 -21.71 61.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 110.305 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.15 -15.3 61.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.482 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.6 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.33 -10.48 18.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.29 0.567 . . . . 0.0 109.52 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.752 ' HB ' HD23 ' B' ' 100' ' ' LEU . 1.6 mm -90.31 126.29 43.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.435 ' HZ2' ' HB3' ' B' ' 52' ' ' CYS . 0.1 OUTLIER -86.67 -41.0 14.56 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.286 0.565 . . . . 0.0 110.063 -179.085 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.624 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -160.71 -177.83 6.44 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.574 -179.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.48 140.47 26.25 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.798 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.046 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.7 mttp -105.15 156.85 17.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.727 HG23 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -132.08 126.85 57.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.414 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -90.52 118.88 69.06 Favored Pre-proline 0 C--O 1.247 0.935 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.54 172.8 11.78 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 124.67 3.58 . . . . 0.0 114.34 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -60.79 160.99 8.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.326 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.52 -29.19 7.72 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -177.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.885 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.4 mttp -89.03 146.69 24.69 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 175.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.73 -4.22 18.82 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.359 0.599 . . . . 0.0 110.392 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.686 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 16.1 pttm -139.54 125.6 19.87 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.181 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mp -78.21 137.69 21.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -136.4 163.2 31.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.55 HD13 ' HG2' ' B' ' 89' ' ' ARG . 1.1 tp -141.66 153.44 44.72 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.442 177.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.046 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.29 143.62 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 178.65 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.958 HD11 HD11 ' B' ' 31' ' ' ILE . 97.1 mt -97.62 106.01 18.25 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.969 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.624 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 18.5 t -90.35 111.82 23.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.501 HD21 HD12 ' B' ' 50' ' ' ILE . 6.6 mt -93.98 156.5 16.58 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.081 0.467 . . . . 0.0 112.203 -177.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.6 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.66 -3.45 44.11 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.247 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.26 -4.59 53.86 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.578 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.36 19.98 53.42 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -126.09 158.23 35.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.564 -0.318 . . . . 0.0 110.406 -179.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.569 HG23 ' HA ' ' B' ' 68' ' ' VAL . 16.6 p -136.0 131.53 35.13 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.6 m -107.23 108.47 19.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.188 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . 0.547 HD22 ' HB3' ' A' ' 400' ' ' ASP . 4.8 m-20 -82.13 154.66 25.42 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.291 0.567 . . . . 0.0 112.001 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.658 ' HZ ' HG22 ' B' ' 43' ' ' ILE . 44.3 m-85 -140.5 111.39 6.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.979 -1.009 . . . . 0.0 109.511 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.62 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.2 t-160 -88.56 104.84 17.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.607 -179.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.685 ' HZ ' HG23 ' B' ' 92' ' ' VAL . 41.6 m-85 -80.43 108.98 14.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 4.4 p -116.7 5.87 13.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.486 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -77.8 91.62 4.13 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.807 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.55 -38.64 1.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.966 0.906 . . . . 0.0 113.367 -178.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -58.26 -59.66 4.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.526 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.82 9.01 6.35 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -176.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.496 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -43.52 -48.3 7.38 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -177.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.43 -52.61 58.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.824 0.345 . . . . 0.0 110.644 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.526 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.4 mttt -67.01 -32.67 74.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.152 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.626 ' O ' HG21 ' B' ' 92' ' ' VAL . 11.5 mt-10 -65.46 -46.12 81.07 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.572 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 4.1 tmm_? -57.94 -40.78 81.34 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . 0.514 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 1.6 m-20 -64.91 -47.36 78.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.016 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.35 -43.57 81.17 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.875 HG13 HD11 ' B' ' 26' ' ' LEU . 41.5 t -61.0 -41.17 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 177.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.727 ' HG3' HG23 ' B' ' 55' ' ' ILE . 1.5 tmmt? -61.32 -57.25 13.1 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.414 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -55.8 15.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.143 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.808 ' HG ' HD11 ' B' ' 99' ' ' LEU . 12.1 tp -62.04 -31.19 71.57 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.568 -178.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 23.0 mt -78.63 -43.99 24.95 Favored 'General case' 0 C--O 1.218 -0.6 0 O-C-N 122.219 -0.301 . . . . 0.0 110.749 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' B' ' 93' ' ' LYS . 21.0 mt-30 -65.56 -17.85 64.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.098 0.951 . . . . 0.0 108.87 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -87.61 -49.56 7.09 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.63 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.808 HD11 ' HG ' ' B' ' 95' ' ' LEU . 12.4 mt -81.49 -33.49 31.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 115.401 1.63 . . . . 0.0 115.401 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.752 HD23 ' HB ' ' B' ' 50' ' ' ILE . 58.8 mt -66.82 -57.27 11.95 Favored Pre-proline 0 C--N 1.317 -0.814 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.635 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 39.4 Cg_exo -58.73 -20.62 52.13 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.399 2.066 . . . . 0.0 114.211 -178.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.66 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 7.2 ptmm? -81.77 -19.72 40.7 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.537 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.434 ' HD1' ' HB2' ' B' ' 47' ' ' TYR . 24.0 m-85 . . . . . 0 C--N 1.33 -0.252 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.428 179.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.817 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.5 mt-10 . . . . . 0 CA--C 1.514 -0.414 0 CA-C-O 120.726 0.298 . . . . 0.0 111.799 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.82 ' HB3' HD22 ' B' ' 76' ' ' ASN . 9.6 p-10 177.86 77.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.643 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.51 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.98 -51.19 0.6 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.412 -0.805 . . . . 0.0 112.964 -178.256 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.53 9.85 0.97 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.315 0.579 . . . . 0.0 110.331 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.867 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -51.92 127.3 20.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.183 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 . . . . . 0 C--N 1.318 -0.776 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.85 -179.39 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 45.5 t . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.71 -29.56 25.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.617 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.468 HD21 ' HG ' ' B' ' 26' ' ' LEU . 7.2 tp -136.12 132.76 36.5 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.41 HG21 ' CE1' ' B' ' 25' ' ' TYR . 60.3 mt -117.2 120.79 66.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.78 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.9 t -112.75 148.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.406 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.59 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.47 175.95 5.26 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.285 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.558 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.17 78.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 O-C-N 125.422 1.701 . . . . 0.0 113.667 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.59 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.8 t -129.04 125.54 62.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.798 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.63 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 38.6 mtp180 -99.68 138.2 37.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.245 0.545 . . . . 0.0 111.502 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.406 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -124.92 114.27 18.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 176.714 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.49 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 0.0 OUTLIER 68.64 31.34 4.68 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.79 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.49 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 76.24 13.06 2.63 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 114.343 -1.298 . . . . 0.0 112.148 -179.763 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.63 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 5.7 tp-100 -105.85 118.9 37.79 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -77.27 149.98 35.36 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 -177.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.665 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -178.39 -155.39 14.3 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.817 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.85 137.6 51.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.139 0.495 . . . . 0.0 110.156 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.935 HD11 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.47 138.97 34.09 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.006 -178.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . 0.41 ' CE1' HG21 ' B' ' 11' ' ' ILE . 61.9 m-85 -134.06 110.14 9.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.68 0.276 . . . . 0.0 110.338 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.886 HD13 HG11 ' B' ' 92' ' ' VAL . 10.8 mt -87.71 129.0 35.3 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.069 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 21.7 mtt -109.27 169.1 8.91 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.968 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.88 -50.61 14.22 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -115.29 6.53 14.96 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -158.42 157.6 32.58 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 119.532 -0.867 . . . . 0.0 112.86 -178.083 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.768 HD11 HD12 ' B' ' 67' ' ' LEU . 1.3 tt -106.77 116.47 50.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 178.049 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -117.97 151.75 36.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.988 0.423 . . . . 0.0 111.044 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.935 ' HB2' HD11 ' B' ' 24' ' ' LEU . 47.4 t90 -147.14 136.41 22.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.873 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -125.73 133.22 24.69 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.382 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.96 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 5.6 Cg_exo -74.81 148.68 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.596 2.197 . . . . 0.0 111.62 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.572 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 73.5 mt-10 -65.54 130.86 44.8 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.102 0.477 . . . . 0.0 110.829 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.03 2.19 62.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.129 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.96 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 4.3 mptt -113.28 148.89 34.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.691 0.281 . . . . 0.0 110.337 179.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -98.06 5.86 48.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.603 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -141.34 152.83 44.74 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.158 0.504 . . . . 0.0 111.844 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -82.98 122.87 28.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.902 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -90.87 -18.61 24.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.31 0.576 . . . . 0.0 110.532 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.599 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 18.1 mm -112.49 117.84 56.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.392 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 25.9 t -148.06 101.46 3.29 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.449 ' CD2' HG21 ' B' ' 43' ' ' ILE . 48.8 m-70 -125.11 138.04 54.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.986 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.5 ' O ' HG12 ' B' ' 50' ' ' ILE . 67.5 mmm -87.94 143.54 27.05 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD21 ' B' ' 100' ' ' LEU . 21.5 m-85 -58.73 -21.86 56.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.907 0.384 . . . . 0.0 110.516 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.91 -13.1 60.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.679 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.625 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.4 -10.67 16.83 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.321 0.582 . . . . 0.0 109.586 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.602 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.6 mm -89.37 127.21 42.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 21.9 tttp -84.8 -44.53 13.19 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.447 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -161.29 -178.03 6.42 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.052 -0.976 . . . . 0.0 108.731 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -144.49 142.15 30.06 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.259 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.106 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 28.6 mttp -108.61 155.26 20.88 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.683 HG22 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.51 127.65 62.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 176.447 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' SER . . . . . 0.404 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -90.64 116.91 67.46 Favored Pre-proline 0 C--O 1.249 1.029 0 C-N-CA 120.016 -0.674 . . . . 0.0 109.432 -179.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 73.6 Cg_endo -69.36 173.37 10.72 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 125.24 3.96 . . . . 0.0 113.767 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -58.38 160.33 5.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.647 -1.16 . . . . 0.0 110.092 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.2 7.87 Favored Glycine 0 C--N 1.315 -0.605 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.787 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 6.7 mttm -88.66 152.92 21.51 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.4 -9.11 55.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.335 0.588 . . . . 0.0 110.456 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.817 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.65 141.98 37.02 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.689 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.686 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -83.85 130.19 36.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.472 HE21 ' HB2' ' B' ' 64' ' ' GLN . 3.6 mt-30 -132.05 162.78 29.94 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 118.805 -1.158 . . . . 0.0 113.851 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.413 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 2.0 tp -139.91 153.56 47.0 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.851 -1.522 . . . . 0.0 107.272 177.06 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.106 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.97 138.21 25.35 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.311 178.869 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.768 HD12 HD11 ' B' ' 31' ' ' ILE . 71.8 mt -94.17 104.94 16.94 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.501 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.692 ' HA ' HG23 ' B' ' 74' ' ' THR . 10.7 t -89.09 109.07 19.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.488 HD13 ' OD1' ' B' ' 73' ' ' ASP . 2.3 mt -93.82 157.26 16.22 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.985 -177.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.625 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -81.31 1.04 34.39 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.232 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -16.17 59.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.548 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 104.25 7.59 40.15 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.939 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . 0.488 ' OD1' HD13 ' B' ' 69' ' ' LEU . 8.7 p-10 -126.37 170.42 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.206 0.527 . . . . 0.0 111.859 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.692 HG23 ' HA ' ' B' ' 68' ' ' VAL . 8.8 p -137.57 131.93 32.39 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.763 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 9.6 m -103.98 112.56 25.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.73 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . 0.82 HD22 ' HB3' ' A' ' 400' ' ' ASP . 4.8 m-20 -84.51 153.87 23.04 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.628 0.728 . . . . 0.0 112.164 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.559 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 36.7 m-85 -133.62 111.86 10.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.573 178.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.558 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.7 t60 -86.59 98.97 11.38 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.701 -177.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.852 ' HB3' ' HB3' ' B' ' 85' ' ' ALA . 41.8 m-85 -77.06 95.57 4.23 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.42 4.97 44.2 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.558 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -80.3 91.35 5.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.125 0.488 . . . . 0.0 110.297 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.18 -42.1 4.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.325 -0.852 . . . . 0.0 113.173 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -59.75 4.72 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 18.1 p -127.62 8.75 6.43 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.852 ' HB3' ' HB3' ' B' ' 79' ' ' PHE . . . -43.75 -47.93 7.99 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -178.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.436 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.11 -52.03 65.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.845 0.355 . . . . 0.0 111.016 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.505 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 6.4 mptt -67.67 -35.09 78.21 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.036 0.446 . . . . 0.0 109.817 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.662 ' O ' HG21 ' B' ' 92' ' ' VAL . 12.0 mt-10 -64.75 -44.79 88.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.686 ' HD3' HG23 ' B' ' 63' ' ' ILE . 28.3 ttp180 -54.55 -47.64 72.97 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . 0.627 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -61.94 -44.86 95.9 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.293 179.687 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.39 -41.43 80.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 117.79 0.268 . . . . 0.0 111.406 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.886 HG11 HD13 ' B' ' 26' ' ' LEU . 41.1 t -62.42 -42.23 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 177.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.683 ' HG3' HG22 ' B' ' 55' ' ' ILE . 1.1 tmmt? -59.43 -56.97 15.26 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.436 177.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.92 -52.99 58.83 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.148 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.727 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.9 tp -61.19 -42.77 99.17 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.038 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.455 HD12 HG12 ' B' ' 92' ' ' VAL . 21.2 mt -68.01 -43.89 77.8 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.18 -24.1 66.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.066 0.936 . . . . 0.0 109.381 178.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -84.9 -49.98 7.91 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.326 -1.306 . . . . 0.0 110.74 178.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.727 HD12 ' HG ' ' B' ' 95' ' ' LEU . 11.9 mt -77.09 -47.28 20.92 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 113.574 -1.648 . . . . 0.0 115.257 -176.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.718 HD21 ' HB3' ' B' ' 47' ' ' TYR . 33.0 mt -50.19 -54.8 30.04 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -176.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 25.9 Cg_endo -60.64 -16.49 43.44 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.091 1.861 . . . . 0.0 113.337 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -87.77 -8.73 55.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.269 179.942 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.996 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.3 tt0 . . . . . 0 CA--C 1.514 -0.41 0 CA-C-O 120.858 0.361 . . . . 0.0 111.304 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.628 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 13.1 p-10 -136.59 93.21 2.84 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.753 0.787 . . . . 0.0 111.803 -178.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.543 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.2 p-10 -139.29 -44.72 0.46 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 16.2 p30 -74.41 12.8 0.69 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.718 0.77 . . . . 0.0 110.103 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.711 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -55.29 121.54 9.13 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.673 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 C--N 1.314 -0.94 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.426 -178.344 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 120.826 0.346 . . . . 0.0 110.289 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 82.4 mt -87.16 -31.93 20.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.711 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 5.9 tp -138.53 134.5 33.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 68.3 mt -117.61 124.18 72.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.733 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.2 t -115.65 149.96 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.652 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.632 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -111.17 179.3 4.08 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.43 -178.943 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.538 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 1.3 mptp? 18.55 70.63 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 O-C-N 124.978 1.424 . . . . 0.0 113.939 -179.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.676 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.0 t -123.39 120.35 59.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.151 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.548 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 3.2 mtm180 -92.38 142.39 27.49 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.198 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.57 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.33 105.38 5.21 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.17 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 mptt 71.91 49.24 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.887 0.742 . . . . 0.0 110.818 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 7.9 mptt 70.6 27.66 3.72 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.647 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.8 pt20 -145.98 132.46 19.73 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.911 -0.493 . . . . 0.0 110.649 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -80.06 153.17 28.95 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.967 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.475 ' HA2' ' H ' ' B' ' 36' ' ' GLU . . . -178.09 -162.67 28.35 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.239 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.99 137.44 54.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.062 0.458 . . . . 0.0 109.863 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.87 HD11 ' HB2' ' B' ' 33' ' ' TRP . 6.3 tp -98.01 141.51 30.88 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.24 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -136.57 113.7 10.61 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.782 HD12 HG12 ' B' ' 92' ' ' VAL . 14.7 mt -90.53 130.99 36.52 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.34 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 15.0 mtt -112.13 159.89 18.09 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.03 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.3 -40.31 5.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -119.53 -4.44 10.34 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 27.2 ptt180 -151.72 158.63 43.64 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.534 -177.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 1.009 HD12 HD12 ' B' ' 67' ' ' LEU . 1.7 tt -107.83 120.49 59.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -120.26 146.85 45.67 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.001 0.429 . . . . 0.0 110.694 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.87 ' HB2' HD11 ' B' ' 24' ' ' LEU . 24.1 t90 -146.83 140.07 25.48 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.508 ' HB3' ' HA ' ' B' ' 41' ' ' PHE . . . -133.93 141.05 38.3 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.798 -179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.454 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 14.3 Cg_exo -65.94 141.51 64.96 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.383 2.055 . . . . 0.0 110.522 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.475 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 4.4 mt-10 -64.57 116.0 5.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.318 0.58 . . . . 0.0 109.589 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 109.61 3.29 30.62 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.781 ' HZ2' ' HA ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -107.14 148.5 28.75 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.403 0.62 . . . . 0.0 111.306 179.467 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -93.32 -22.35 19.02 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.473 -1.24 . . . . 0.0 111.828 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.1 133.77 55.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.73 0.3 . . . . 0.0 111.174 -178.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.508 ' HA ' ' HB3' ' B' ' 34' ' ' ALA . 75.2 m-85 -68.66 120.98 15.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' THR . . . . . 0.433 ' OG1' ' HD3' ' B' ' 35' ' ' PRO . 0.8 OUTLIER -79.91 -39.33 30.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.023 0.44 . . . . 0.0 110.638 -179.799 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.615 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 17.6 mm -93.08 119.12 40.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.954 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -147.95 101.22 3.28 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.445 ' CD2' HG22 ' B' ' 43' ' ' ILE . 52.3 m-70 -132.05 143.32 49.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.935 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.458 ' HE3' ' HB3' ' B' ' 46' ' ' MET . 5.9 mtp -91.36 145.16 24.87 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.765 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.51 -21.69 39.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.045 0.45 . . . . 0.0 110.413 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.65 -10.7 59.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.992 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.612 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.01 -4.59 17.69 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.315 0.578 . . . . 0.0 109.831 179.624 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.728 ' HB ' HD21 ' B' ' 100' ' ' LEU . 2.7 mm -90.3 132.84 33.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.528 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 17.7 ttpt -88.86 -41.84 12.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.274 0.559 . . . . 0.0 109.713 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.725 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 24.3 p -162.35 -178.0 6.03 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.403 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -146.73 139.24 25.01 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.741 0.305 . . . . 0.0 110.853 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.042 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 19.0 mttp -109.58 156.5 20.1 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.538 HG22 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.37 128.09 63.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 176.048 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' SER . . . . . 0.406 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -89.03 118.92 69.68 Favored Pre-proline 0 C--O 1.249 1.036 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.32 173.18 13.49 Favored 'Trans proline' 0 C--O 1.234 0.316 1 C-N-CA 125.311 4.008 . . . . 0.0 114.559 -177.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -60.21 160.98 7.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.201 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.31 -29.14 7.82 Favored Glycine 0 C--N 1.316 -0.53 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.996 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 10.0 mttp -90.7 154.0 19.87 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 2.76 8.49 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.236 0.541 . . . . 0.0 110.502 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.23 148.04 32.08 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.526 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.64 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -96.86 136.54 27.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.406 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 10.5 mt-30 -138.7 163.24 32.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.57 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.6 153.59 47.4 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 113.812 -1.54 . . . . 0.0 106.862 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.042 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -145.99 134.49 22.03 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 119.302 0.955 . . . . 0.0 111.266 178.845 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 1.009 HD12 HD12 ' B' ' 31' ' ' ILE . 26.0 mt -94.15 104.15 16.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.768 178.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.725 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -88.62 103.73 14.1 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.578 HD21 HD11 ' B' ' 50' ' ' ILE . 2.4 mt -89.25 157.86 18.07 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.05 -177.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.612 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.3 0.27 37.77 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.018 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.79 -10.16 59.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.15 11.57 54.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.002 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -126.41 154.72 43.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.605 HG22 ' HA ' ' B' ' 68' ' ' VAL . 13.7 p -124.11 131.01 53.5 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.588 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 1.4 m -103.64 98.63 8.48 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . 0.518 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 4.8 m-20 -85.74 122.36 29.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.404 0.621 . . . . 0.0 111.885 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.612 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 63.0 m-85 -103.81 113.37 26.85 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.008 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.676 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.9 t60 -86.59 100.0 12.11 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.041 -178.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.723 ' HZ ' HG21 ' B' ' 92' ' ' VAL . 54.8 m-85 -76.84 88.18 3.44 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.09 13.09 35.69 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.538 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.8 t-20 -83.22 92.94 7.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.318 0.58 . . . . 0.0 109.933 179.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.06 -34.9 0.79 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.84 -59.57 3.42 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -178.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.524 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -127.36 11.6 6.92 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -176.151 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.656 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -44.9 -47.87 11.24 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.96 -52.1 65.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.887 0.375 . . . . 0.0 110.817 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.524 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.8 mttt -66.6 -34.11 77.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.922 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.602 ' O ' HG22 ' B' ' 92' ' ' VAL . 12.1 mt-10 -65.71 -44.44 86.08 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.64 ' HD3' HG23 ' B' ' 63' ' ' ILE . 26.2 ttp180 -56.29 -47.86 77.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . 0.515 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.43 -44.38 96.55 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 113.865 -1.516 . . . . 0.0 112.381 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.14 -44.46 79.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.767 0.258 . . . . 0.0 111.312 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.782 HG12 HD12 ' B' ' 26' ' ' LEU . 48.9 t -60.33 -44.09 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.538 ' HG3' HG22 ' B' ' 55' ' ' ILE . 1.1 tmmt? -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.724 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -55.53 25.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.895 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.729 ' HG ' HD13 ' B' ' 99' ' ' LEU . 12.4 tp -63.26 -32.56 74.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.139 -179.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.516 HD11 HG13 ' B' ' 92' ' ' VAL . 20.9 mt -76.36 -39.26 54.32 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -66.08 -18.58 65.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.289 1.042 . . . . 0.0 108.621 178.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -87.88 -48.4 7.84 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.521 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.729 HD13 ' HG ' ' B' ' 95' ' ' LEU . 16.3 mt -82.8 -37.32 24.68 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 -176.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.765 HD23 ' HB3' ' B' ' 47' ' ' TYR . 66.4 mt -63.48 -58.44 15.48 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.684 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 37.7 Cg_exo -58.57 -23.49 65.23 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.245 1.964 . . . . 0.0 113.499 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.43 ' HE2' ' HB2' ' B' ' 102' ' ' LYS . 2.3 ptmm? -88.15 1.37 54.52 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.468 ' HD1' ' O ' ' B' ' 99' ' ' LEU . 21.6 m-85 . . . . . 0 C--N 1.33 -0.262 0 CA-C-O 120.705 0.288 . . . . 0.0 111.132 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.946 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.7 tt0 . . . . . 0 CA--C 1.513 -0.466 0 CA-C-O 120.92 0.39 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.59 ' HB2' ' CE2' ' A' ' 403' ' ' PHE . 11.8 p-10 -134.0 94.46 3.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.76 0.79 . . . . 0.0 111.857 -178.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.524 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.42 -46.98 0.46 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -73.31 12.09 0.64 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.377 0.608 . . . . 0.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.643 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -53.29 115.96 2.17 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.596 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.321 -0.66 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.54 HG22 ' HE1' ' B' ' 27' ' ' MET . 90.9 t . . . . . 0 CA--C 1.516 -0.342 0 CA-C-O 121.371 0.605 . . . . 0.0 111.477 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.47 ' HB2' HD22 ' B' ' 95' ' ' LEU . 23.4 mt -97.79 -31.61 12.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.34 179.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.3 tp -132.97 137.8 46.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.8 mt -122.34 121.59 64.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.5 t -110.6 148.67 13.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.136 -179.373 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.565 ' HD3' ' N ' ' B' ' 13' ' ' LYS . 0.1 OUTLIER -108.3 174.09 6.03 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.673 -178.78 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 18.0 70.05 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 O-C-N 125.084 1.49 . . . . 0.0 114.27 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.548 HG21 ' O ' ' B' ' 13' ' ' LYS . 39.1 t -116.21 120.98 66.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.604 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 31.9 mtp180 -96.7 119.85 35.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.154 0.502 . . . . 0.0 110.953 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' B' ' 76' ' ' ASN . 10.7 tm0? -109.98 119.84 40.58 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.585 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 65.56 33.52 8.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -178.262 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.35 18.65 7.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.332 -1.304 . . . . 0.0 111.552 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.569 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tp-100 -110.12 119.1 38.21 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.33 144.4 56.59 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.746 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . -178.92 -165.94 34.12 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.409 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.59 136.81 53.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.071 0.462 . . . . 0.0 109.897 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.868 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.81 142.22 29.84 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.4 -177.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -135.03 124.16 24.38 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.895 HD13 HG13 ' B' ' 92' ' ' VAL . 19.3 mt -105.3 121.11 43.19 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.643 -178.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.542 ' HE3' ' HB1' ' B' ' 32' ' ' ALA . 2.3 mpt? -97.88 159.13 15.13 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.79 -21.54 56.27 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -116.87 -16.85 10.55 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -154.84 164.73 38.4 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.374 -176.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.943 HD12 HD13 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -114.32 122.55 68.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.233 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.542 ' HB1' ' HE3' ' B' ' 27' ' ' MET . . . -125.45 152.55 44.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.033 0.444 . . . . 0.0 110.512 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.868 ' HB2' HD12 ' B' ' 24' ' ' LEU . 21.9 t90 -146.87 136.81 23.3 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.443 ' HB1' ' CD1' ' B' ' 41' ' ' PHE . . . -122.38 135.35 25.46 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.185 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 1.094 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 4.8 Cg_exo -72.08 150.09 53.57 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.54 2.16 . . . . 0.0 111.803 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.746 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.1 mt-10 -63.66 124.41 21.36 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.928 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.59 6.47 62.43 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 1.094 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 10.0 mptt -113.32 149.71 33.57 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -97.06 -1.39 45.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.888 -178.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -132.63 151.07 52.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.169 0.509 . . . . 0.0 112.055 -178.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.443 ' CD1' ' HB1' ' B' ' 34' ' ' ALA . 44.1 m-85 -83.88 121.26 27.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.678 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.1 p -87.53 -21.85 25.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.208 0.528 . . . . 0.0 110.487 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.577 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 11.5 mm -102.39 122.98 55.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.23 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.3 t -147.68 101.56 3.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.183 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.505 ' CD2' HG21 ' B' ' 43' ' ' ILE . 51.0 m-70 -133.99 139.44 46.06 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.471 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.4 mtp -96.94 148.68 22.71 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.671 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.4 m-85 -58.18 -23.2 54.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.853 0.359 . . . . 0.0 111.287 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.99 -25.28 62.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.053 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.62 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -97.15 -4.76 38.66 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.823 0.344 . . . . 0.0 110.833 -179.614 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.56 HD11 HD21 ' B' ' 69' ' ' LEU . 4.1 mm -83.45 131.48 33.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.42 ' HB2' ' N ' ' B' ' 70' ' ' HIS . 13.7 tttm -91.94 -37.19 13.01 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.73 0.3 . . . . 0.0 110.352 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.577 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.6 p -169.39 179.97 3.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -139.83 143.83 37.0 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.271 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.15 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 16.9 mttm -115.3 150.1 36.78 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.506 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.7 OUTLIER -130.57 129.25 64.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.653 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' SER . . . . . 0.472 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -91.34 121.15 67.99 Favored Pre-proline 0 C--O 1.249 1.028 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.283 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -72.56 173.44 13.27 Favored 'Trans proline' 0 C--O 1.234 0.318 1 C-N-CA 125.586 4.191 . . . . 0.0 114.733 -177.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -58.67 160.64 5.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.407 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.92 -29.01 8.03 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 -178.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.946 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.9 mttp -89.81 154.62 19.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.3 -11.85 61.18 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.216 0.532 . . . . 0.0 110.299 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.626 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.15 140.84 40.04 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.769 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.565 HG22 ' HD3' ' B' ' 89' ' ' ARG . 3.3 mp -85.21 140.3 16.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . 0.472 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 18.8 mt-30 -139.94 163.18 33.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.455 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.3 tp -142.54 153.54 43.67 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.339 176.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.15 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 137.22 23.73 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 119.241 0.928 . . . . 0.0 110.939 178.281 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.943 HD13 HD12 ' B' ' 31' ' ' ILE . 96.4 mt -94.14 104.09 16.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.869 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.577 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 5.7 t -88.59 110.78 21.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.56 HD21 HD11 ' B' ' 50' ' ' ILE . 4.4 mt -97.57 155.9 16.76 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.62 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.6 OUTLIER -81.67 2.95 27.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.013 178.218 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.85 -5.83 59.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.157 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.31 16.14 53.94 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.547 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -126.12 154.3 43.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.759 0.314 . . . . 0.0 110.775 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.485 HG23 ' HA ' ' B' ' 68' ' ' VAL . 17.0 p -130.23 130.71 44.95 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.583 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.2 m -106.56 98.98 8.58 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.62 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . 0.48 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 5.3 m-20 -82.41 147.09 28.97 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.848 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.518 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 59.2 m-85 -131.24 112.71 13.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.834 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.604 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.7 t-160 -87.03 99.91 12.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.285 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.752 ' HB3' ' HB2' ' B' ' 85' ' ' ALA . 43.1 m-85 -75.07 100.02 4.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.53 11.4 28.76 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.438 ' O ' ' HB1' ' B' ' 85' ' ' ALA . 1.7 t-20 -85.66 91.66 8.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.243 0.544 . . . . 0.0 109.733 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.58 -34.23 2.07 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.23 -57.66 7.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.499 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.48 8.72 6.5 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -176.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.752 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -43.93 -47.27 8.43 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -178.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 t -59.84 -54.18 38.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.915 0.388 . . . . 0.0 110.747 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.499 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -65.55 -33.36 75.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.959 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.663 ' O ' HG22 ' B' ' 92' ' ' VAL . 12.7 mt-10 -66.09 -45.39 81.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.565 ' HD3' HG22 ' B' ' 63' ' ' ILE . 17.6 ttp180 -56.06 -47.91 77.04 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . 0.674 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -61.22 -44.19 97.67 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 113.619 -1.628 . . . . 0.0 111.96 179.797 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.61 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.704 0.229 . . . . 0.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.895 HG13 HD13 ' B' ' 26' ' ' LEU . 45.4 t -62.81 -44.69 99.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.674 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.8 OUTLIER -58.82 -52.68 64.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.793 178.254 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . 0.433 ' HA ' ' HG2' ' B' ' 97' ' ' GLN . 1.2 m-20 -58.67 -53.29 59.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.81 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.719 ' HG ' HD13 ' B' ' 99' ' ' LEU . 13.2 tp -60.64 -38.58 85.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 25.8 mt -70.15 -45.44 66.76 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . 0.433 ' HG2' ' HA ' ' B' ' 94' ' ' ASP . 19.7 pt20 -64.85 -18.07 64.83 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.218 1.009 . . . . 0.0 109.195 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -85.91 -49.78 7.61 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.928 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.719 HD13 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -78.96 -47.25 16.68 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.473 -1.694 . . . . 0.0 115.146 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.671 HD23 ' HB3' ' B' ' 47' ' ' TYR . 34.9 mt -52.23 -56.3 23.43 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 32.2 Cg_exo -61.59 -13.43 29.72 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.398 2.065 . . . . 0.0 113.417 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 7.9 mtmm -85.48 -23.17 27.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.982 0.42 . . . . 0.0 110.285 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 . . . . . 0 C--N 1.325 -0.495 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.944 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 399' ' ' GLU . . . . . 0.88 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 63.0 tt0 . . . . . 0 CA--C 1.509 -0.624 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 400' ' ' ASP . . . . . 0.628 ' HB3' ' CD1' ' A' ' 403' ' ' PHE . 0.8 OUTLIER -133.67 90.74 2.75 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -175.513 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 401' ' ' ASP . . . . . 0.566 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -138.99 -48.41 0.5 Allowed 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -72.06 13.59 0.29 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.929 0.871 . . . . 0.0 110.538 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 403' ' ' PHE . . . . . 0.962 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -61.68 119.39 8.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.192 -1.367 . . . . 0.0 111.025 179.553 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 404' ' ' ASN . . . . . 0.401 ' O ' ' HA ' ' B' ' 54' ' ' LYS . 41.7 m-80 . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.775 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 63.9 t . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.7 mt -82.78 -31.11 28.42 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.515 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.6 tp -132.53 123.03 25.74 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.1 mt -109.6 120.64 61.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . 0.735 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.0 t -112.91 149.62 15.32 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' LYS . . . . . 0.586 ' O ' HG22 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -109.48 -179.94 3.97 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.984 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . 0.431 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.8 mttp 17.95 76.31 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 125.393 1.683 . . . . 0.0 113.533 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.586 HG22 ' O ' ' B' ' 13' ' ' LYS . 39.6 t -127.9 125.0 64.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.615 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 1.4 mtt-85 -99.04 146.11 26.39 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.388 0.614 . . . . 0.0 112.201 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . 0.538 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 6.4 tp-100 -119.75 102.71 8.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 1.1 mptp? 55.61 56.73 5.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.104 -178.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 3.2 mptm? 76.33 9.75 3.1 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 178.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' GLN . . . . . 0.674 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 5.9 pt20 -119.56 119.65 34.41 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.173 0.897 . . . . 0.0 110.755 178.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.538 ' OD2' ' HD3' ' B' ' 16' ' ' ARG . 2.1 m-20 -72.42 149.68 44.04 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.609 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -175.98 -161.31 24.97 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.744 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.36 139.45 53.66 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.859 HD13 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.75 137.28 39.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.743 -178.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -133.46 108.72 8.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.826 0.346 . . . . 0.0 110.412 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . 0.932 HD13 HG11 ' B' ' 92' ' ' VAL . 10.7 mt -84.59 121.42 27.6 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.905 0.383 . . . . 0.0 110.332 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' MET . . . . . 0.43 ' HB2' ' HG2' ' B' ' 30' ' ' ARG . 0.5 OUTLIER -99.38 166.32 11.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.486 -178.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.2 -52.99 8.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' GLU . . . . . 0.446 ' CD ' HH21 ' B' ' 30' ' ' ARG . 1.5 mp0 -114.2 7.03 16.46 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' ARG . . . . . 0.446 HH21 ' CD ' ' B' ' 29' ' ' GLU . 10.1 ptp180 -158.94 157.86 32.2 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.513 -0.875 . . . . 0.0 112.682 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' ILE . . . . . 0.873 HD13 HD13 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -103.68 119.03 51.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.345 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.516 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -115.31 147.07 40.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.911 0.386 . . . . 0.0 110.801 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' TRP . . . . . 0.859 ' HB2' HD13 ' B' ' 24' ' ' LEU . 35.9 t90 -147.18 145.46 29.51 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 1.038 ' HB2' ' HG3' ' B' ' 38' ' ' LYS . . . -145.44 133.23 10.45 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.746 -0.206 . . . . 0.0 111.183 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' PRO . . . . . 0.609 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 69.7 Cg_endo -70.68 132.77 22.48 Favored 'Trans proline' 0 N--CA 1.476 0.474 0 C-N-CA 123.457 2.771 . . . . 0.0 111.79 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.494 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 0.0 OUTLIER -50.3 132.17 24.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.194 -178.453 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.73 11.03 39.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -177.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 1.038 ' HG3' ' HB2' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -99.62 166.7 11.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.585 -0.807 . . . . 0.0 111.953 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -124.22 -4.98 7.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.444 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -146.2 164.09 33.35 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.259 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.673 ' HA ' ' HB1' ' B' ' 34' ' ' ALA . 36.2 m-85 -88.22 130.86 34.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.229 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.3 p -94.33 -25.92 16.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.56 . . . . 0.0 110.32 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.759 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -106.04 120.68 57.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.302 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 45.8 t -147.91 101.43 3.3 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' HIS . . . . . 0.415 ' CD2' HG22 ' B' ' 43' ' ' ILE . 79.9 m-70 -123.33 137.96 54.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' MET . . . . . 0.47 ' O ' HG12 ' B' ' 50' ' ' ILE . 70.9 mmm -85.9 140.91 29.96 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD21 ' B' ' 100' ' ' LEU . 22.9 m-85 -57.66 -22.85 48.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.969 0.414 . . . . 0.0 110.501 179.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.77 -22.31 60.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.807 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.648 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -96.32 -6.82 36.87 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.11 0.481 . . . . 0.0 110.067 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.619 ' HB ' HD22 ' B' ' 100' ' ' LEU . 4.4 mm -87.28 118.22 32.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.613 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 0.6 OUTLIER -79.39 -30.88 42.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.226 0.536 . . . . 0.0 109.615 -178.655 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.613 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 9.4 p -176.1 173.69 2.17 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.751 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 18.8 pm0 -132.42 137.91 47.46 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.199 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 1.105 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -104.75 148.97 26.02 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . 0.497 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.8 OUTLIER -127.25 127.04 68.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 175.998 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -88.3 116.66 66.88 Favored Pre-proline 0 C--O 1.252 1.188 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.83 173.3 11.23 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 125.211 3.941 . . . . 0.0 114.484 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -60.73 160.33 9.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.47 -29.06 8.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.331 -1.507 . . . . 0.0 109.331 -177.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.88 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.5 mttp -88.45 152.26 22.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 176.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.4 -8.98 51.42 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 121.127 0.489 . . . . 0.0 110.942 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' LYS . . . . . 0.492 ' CE ' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -141.74 140.8 33.2 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.597 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' ILE . . . . . 0.595 HG21 ' HD3' ' B' ' 89' ' ' ARG . 3.4 mp -86.31 135.49 24.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 178.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -139.5 163.31 32.88 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 118.897 -1.121 . . . . 0.0 113.992 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 1.7 tp -138.88 153.07 48.26 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.054 -1.43 . . . . 0.0 107.522 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 1.105 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 142.96 28.3 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 119.25 0.932 . . . . 0.0 111.183 178.201 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.873 HD13 HD13 ' B' ' 31' ' ' ILE . 95.7 mt -95.29 103.13 14.98 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.925 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . 0.718 ' HA ' HG23 ' B' ' 74' ' ' THR . 12.3 t -87.12 115.94 28.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.522 HD22 HD11 ' B' ' 50' ' ' ILE . 4.1 mt -101.13 154.87 18.36 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.11 0.481 . . . . 0.0 111.952 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.648 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.43 -1.95 36.05 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.384 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.99 -15.3 61.1 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.63 178.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 102.8 7.45 44.61 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.929 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' ASP . . . . . 0.477 ' OD2' HD12 ' B' ' 69' ' ' LEU . 4.8 p-10 -126.44 167.71 15.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.117 0.484 . . . . 0.0 111.572 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' THR . . . . . 0.718 HG23 ' HA ' ' B' ' 68' ' ' VAL . 33.2 p -136.63 131.45 33.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.752 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' THR . . . . . 0.562 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.2 m -100.57 99.33 9.89 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 178.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' ASN . . . . . 0.401 HD21 ' CG ' ' A' ' 400' ' ' ASP . 2.5 m-20 -82.46 148.17 28.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.238 0.542 . . . . 0.0 111.485 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' PHE . . . . . 0.759 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 54.0 m-85 -131.59 113.99 14.3 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.767 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' HIS . . . . . 0.557 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.8 t-160 -87.05 105.3 17.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.447 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.724 ' HB3' ' HB2' ' B' ' 85' ' ' ALA . 29.0 m-85 -76.41 97.48 4.29 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -95.18 7.27 46.67 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' ASN . . . . . 0.431 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 54.7 t30 -81.35 91.19 6.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.128 0.49 . . . . 0.0 110.451 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.66 -24.97 9.52 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -59.98 2.46 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' THR . . . . . 0.519 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.7 p -127.82 13.46 6.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -176.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . 0.724 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -46.15 -44.36 15.79 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.448 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.6 -53.52 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.027 0.442 . . . . 0.0 110.488 179.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.519 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.48 -34.91 78.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.264 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.662 ' O ' HG23 ' B' ' 92' ' ' VAL . 13.5 mt-10 -67.5 -44.22 78.99 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . 0.595 ' HD3' HG21 ' B' ' 63' ' ' ILE . 22.5 ttp180 -55.42 -47.08 76.52 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.133 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -42.28 99.27 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.57 -1.65 . . . . 0.0 112.466 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.47 -43.65 76.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.72 0.236 . . . . 0.0 111.078 179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.932 HG11 HD13 ' B' ' 26' ' ' LEU . 35.2 t -60.28 -44.45 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 177.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' B' ' 97' ' ' GLN . 0.5 OUTLIER -58.18 -54.87 42.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.089 178.337 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . 0.589 ' HA ' ' NE2' ' B' ' 97' ' ' GLN . 4.2 m-20 -56.73 -53.95 51.88 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.195 -179.069 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . 0.651 ' HG ' HD11 ' B' ' 99' ' ' LEU . 13.5 tp -61.56 -32.67 72.76 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.472 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.63 -41.12 65.86 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 97' ' ' GLN . . . . . 0.589 ' NE2' ' HA ' ' B' ' 94' ' ' ASP . 7.4 mt-30 -63.08 -22.67 67.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.149 0.976 . . . . 0.0 108.684 178.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.63 -47.42 9.2 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.793 -1.549 . . . . 0.0 111.439 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 99' ' ' LEU . . . . . 0.651 HD11 ' HG ' ' B' ' 95' ' ' LEU . 14.7 mt -80.05 -47.76 14.35 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.124 -1.398 . . . . 0.0 114.757 -176.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.718 HD21 ' HB3' ' B' ' 47' ' ' TYR . 59.2 mt -52.55 -56.97 17.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -176.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 101' ' ' PRO . . . . . 0.632 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.1 Cg_exo -56.83 -13.19 10.74 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.711 2.274 . . . . 0.0 113.875 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -87.15 -9.5 55.09 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.368 -0.208 . . . . 0.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.496 -179.774 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 30.2 p90 . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 23.1 t -61.48 119.83 6.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.758 0.313 . . . . 0.0 110.545 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 87.83 -78.02 1.84 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.77 -0.728 . . . . 0.0 111.331 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -91.45 119.96 31.88 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -133.81 29.24 3.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.798 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.499 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -60.31 -35.57 75.91 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.342 179.033 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 4.1 tt0 169.21 -79.25 0.0 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.693 177.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.96 ' HG3' ' HE2' ' B' ' 62' ' ' LYS . 0.5 OUTLIER -139.78 113.12 8.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.255 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -138.44 84.46 2.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.203 -178.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.561 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -139.09 -49.49 0.51 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.234 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -71.29 11.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.602 0.715 . . . . 0.0 110.177 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.679 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -54.76 114.12 1.59 Allowed 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.186 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -94.36 133.1 38.28 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.268 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.424 ' HG2' ' HG2' ' B' ' 54' ' ' LYS . 23.2 mm-40 -81.14 175.09 10.94 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.952 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -164.28 -22.22 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.104 -0.638 . . . . 0.0 111.738 178.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.78 -19.75 37.18 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.157 179.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 75.82 -174.4 0.11 Allowed 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.598 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.27 86.23 3.7 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 121.568 0.699 . . . . 0.0 111.232 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.597 ' HB3' ' HG2' ' B' ' 51' ' ' LYS . 16.1 t70 . . . . . 0 C--O 1.245 0.865 0 CA-C-N 115.142 -0.936 . . . . 0.0 109.43 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.63 61.86 0.31 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 109.945 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 12.7 m -156.64 -68.07 0.11 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.674 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.416 ' C ' ' H ' ' B' ' 6' ' ' GLU . 0.0 OUTLIER -104.52 -18.7 14.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.949 0.404 . . . . 0.0 111.051 -179.528 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' SER . . . . . 0.51 ' HB3' ' HB2' ' B' ' 29' ' ' GLU . 4.6 p -76.79 19.73 0.27 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.85 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' B' ' 4' ' ' SER . 2.7 mm-40 -105.77 2.08 27.57 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.852 0.834 . . . . 0.0 109.039 -179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -112.76 135.92 52.96 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.938 -1.483 . . . . 0.0 108.891 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 99.0 t -93.34 122.52 44.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.19 0.519 . . . . 0.0 111.471 -178.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.5 mt -95.57 -29.51 14.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.498 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.657 HD21 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.07 123.91 26.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.749 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.433 HG22 ' CE1' ' B' ' 25' ' ' TYR . 55.5 mt -108.95 122.65 63.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.826 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.9 t -115.07 150.05 17.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.604 ' O ' HG22 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.66 177.25 4.74 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.064 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.566 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.15 75.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 125.555 1.784 . . . . 0.0 112.971 -178.654 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.604 HG22 ' O ' ' B' ' 13' ' ' LYS . 25.1 t -123.82 119.7 57.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.1 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.58 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 30.8 mtp180 -89.42 128.42 35.94 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.858 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -126.9 104.33 7.97 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.685 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.22 50.88 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.771 179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.499 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 0.3 OUTLIER 66.26 26.13 10.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.752 178.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.515 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.1 tt0 -138.31 121.59 17.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.776 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.417 ' HA ' ' HA ' ' B' ' 16' ' ' ARG . 2.1 t70 -76.94 154.0 34.06 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.894 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -178.27 -156.12 15.97 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.218 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 133.57 48.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.921 HD13 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.47 142.19 29.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.516 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . 0.433 ' CE1' HG22 ' B' ' 11' ' ' ILE . 50.3 m-85 -137.72 110.59 7.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.913 HD13 HG12 ' B' ' 92' ' ' VAL . 9.3 mt -87.97 128.45 35.38 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 12.5 mtt -108.24 166.6 10.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.63 -47.91 14.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.51 ' HB2' ' HB3' ' B' ' 5' ' ' SER . 4.0 mt-10 -117.11 3.68 12.71 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.436 ' HG2' ' HB2' ' B' ' 5' ' ' SER . 12.4 ptt180 -156.11 153.24 29.02 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.624 -0.83 . . . . 0.0 112.515 -177.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.978 HD11 HD12 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.78 121.43 52.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.09 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.487 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.08 153.74 37.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.913 0.387 . . . . 0.0 110.783 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.921 ' HB2' HD13 ' B' ' 24' ' ' LEU . 45.6 t90 -147.26 134.17 20.21 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.475 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -111.98 127.41 26.9 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.714 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.491 ' HG2' ' HB2' ' B' ' 38' ' ' LYS . 58.9 Cg_endo -75.05 142.69 28.0 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.461 2.107 . . . . 0.0 111.801 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -58.77 133.6 56.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.721 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.11 -5.81 75.66 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.398 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.491 ' HB2' ' HG2' ' B' ' 35' ' ' PRO . 1.7 mppt? -113.39 153.55 28.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -98.04 -11.94 22.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.3 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -118.66 152.9 35.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.081 0.467 . . . . 0.0 112.002 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.475 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 21.7 m-85 -81.19 122.8 27.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.6 p -91.58 -8.72 46.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.269 0.557 . . . . 0.0 110.328 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.672 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 15.2 mm -117.08 119.54 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.189 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.3 t -148.0 101.52 3.3 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.462 ' CD2' HG21 ' B' ' 43' ' ' ILE . 73.8 m-70 -124.87 137.72 54.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.004 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.482 ' HB2' ' OD2' ' B' ' 49' ' ' ASP . 21.6 mmm -86.53 140.27 30.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.643 ' HB3' HD21 ' B' ' 100' ' ' LEU . 21.7 m-85 -57.56 -23.08 48.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.846 0.355 . . . . 0.0 110.544 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.13 -20.48 61.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.968 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.605 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -98.55 -8.89 25.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.087 0.47 . . . . 0.0 110.318 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.651 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.7 mm -87.43 127.66 40.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.597 ' HG2' ' HB3' ' A' ' 410' ' ' ASP . 7.6 tttp -88.44 -46.67 8.95 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.548 0.689 . . . . 0.0 109.727 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.657 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.8 p -154.48 -177.9 6.78 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.145 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . 0.582 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 10.3 pt20 -144.18 143.34 31.04 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.717 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.009 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 25.7 mttp -113.08 153.04 28.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.513 HD12 ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -130.06 127.04 62.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 176.202 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' SER . . . . . 0.526 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -87.51 120.0 70.95 Favored Pre-proline 0 C--O 1.249 1.041 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.51 172.94 12.41 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 124.864 3.709 . . . . 0.0 113.928 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -61.76 160.3 12.06 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.888 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.01 8.1 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.619 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 5.2 mttp -85.11 162.96 19.06 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.26 -5.85 46.76 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.308 0.575 . . . . 0.0 110.478 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.96 ' HE2' ' HG3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -146.86 157.73 43.73 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.373 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.607 HG22 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -96.64 134.44 34.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.54 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 24.0 mt-30 -135.5 163.24 30.52 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.58 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -141.83 153.22 44.34 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 113.547 -1.66 . . . . 0.0 107.377 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.009 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -146.54 139.68 25.58 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 119.052 0.842 . . . . 0.0 111.256 178.742 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.978 HD12 HD11 ' B' ' 31' ' ' ILE . 96.2 mt -94.23 104.58 16.58 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.77 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.657 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.5 t -91.36 111.71 24.28 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.463 HD23 HD12 ' B' ' 50' ' ' ILE . 5.2 mt -94.23 157.57 15.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.605 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -79.02 -4.77 51.73 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.423 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.8 -5.61 53.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.636 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.6 20.69 50.45 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . 0.403 ' HB3' HD11 ' B' ' 69' ' ' LEU . 20.9 t70 -125.91 158.78 34.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.354 -0.423 . . . . 0.0 110.415 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.53 HG23 ' HA ' ' B' ' 68' ' ' VAL . 16.1 p -137.5 131.14 31.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.836 0.351 . . . . 0.0 110.316 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.546 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.13 101.09 10.6 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.062 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.51 137.92 32.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.207 0.527 . . . . 0.0 111.719 -178.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.672 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 53.2 m-85 -122.77 111.46 16.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.899 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.58 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.8 t-160 -88.43 104.14 16.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.132 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.615 ' HZ ' HG23 ' B' ' 92' ' ' VAL . 58.4 m-85 -75.09 100.22 4.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.14 -2.02 47.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.566 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.2 t-20 -79.78 91.29 5.31 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.27 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.86 -37.77 9.32 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 52.4 m -53.85 -59.42 4.65 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.538 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.6 p -127.57 9.94 6.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -176.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.555 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.41 -48.9 7.17 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.545 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.1 -51.87 67.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.983 0.421 . . . . 0.0 110.87 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.538 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 7.6 mttt -67.48 -34.92 78.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.053 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.644 ' O ' HG21 ' B' ' 92' ' ' VAL . 11.9 mt-10 -64.64 -46.86 80.73 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.607 ' HD3' HG22 ' B' ' 63' ' ' ILE . 25.3 ttp180 -53.83 -47.73 70.63 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.88 -46.47 87.7 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.6 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.08 -42.39 89.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 118.137 0.426 . . . . 0.0 111.164 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.913 HG12 HD13 ' B' ' 26' ' ' LEU . 47.9 t -60.95 -43.87 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.582 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.3 ttpm? -59.52 -55.21 37.49 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.843 178.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.75 -54.12 42.65 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.908 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.633 ' HG ' HD11 ' B' ' 99' ' ' LEU . 13.5 tp -61.99 -38.36 88.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.807 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 24.7 mt -70.58 -43.31 69.66 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' B' ' 93' ' ' LYS . 37.3 mt-30 -63.69 -21.13 66.23 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 122.158 0.98 . . . . 0.0 109.051 178.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -84.15 -50.59 7.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.159 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.633 HD11 ' HG ' ' B' ' 95' ' ' LEU . 17.4 mt -78.62 -46.68 18.71 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -176.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.651 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.2 mt -49.86 -60.07 5.74 Favored Pre-proline 0 N--CA 1.468 0.443 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -176.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.87 -13.88 37.46 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.17 1.913 . . . . 0.0 113.828 -178.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 18.9 mtmm -87.78 -6.34 58.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.433 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -127.18 -28.18 2.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.594 ' HE2' ' HB3' ' B' ' 100' ' ' LEU . 7.5 pttt -94.92 170.06 9.7 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.31 0.576 . . . . 0.0 111.364 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.86 128.6 20.43 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 178.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.45 ' HA ' ' OD1' ' A' ' 410' ' ' ASP . 8.5 mtpm? -46.5 149.71 0.75 Allowed 'General case' 0 C--N 1.327 -0.39 0 O-C-N 124.174 0.922 . . . . 0.0 112.528 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.27 4.53 38.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.322 1.058 . . . . 0.0 108.504 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 41.8 t30 . . . . . 0 C--O 1.251 1.179 0 CA-C-N 113.065 -1.88 . . . . 0.0 108.159 179.75 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.421 ' HD1' HG11 ' A' ' 393' ' ' VAL . 5.5 p90 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . 0.421 HG11 ' HD1' ' A' ' 392' ' ' TYR . 5.9 p -61.54 -43.48 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 120.855 0.36 . . . . 0.0 110.867 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -89.32 70.34 2.45 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.633 ' OE2' ' HE2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 75.4 157.42 0.19 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.591 0.756 . . . . 0.0 110.096 -178.281 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.552 ' O ' ' HE3' ' B' ' 19' ' ' LYS . 3.2 t70 -130.19 31.24 4.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.637 -178.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.514 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 0.8 OUTLIER -57.48 -42.18 82.14 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.562 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.485 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 7.7 tt0 172.86 -62.01 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.671 0.607 . . . . 0.0 111.119 178.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.949 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.8 tt0 -154.58 90.69 1.34 Allowed 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.43 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -132.24 93.09 3.2 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.535 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.9 p-10 -138.42 -45.34 0.5 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.618 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -74.12 13.37 0.56 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.723 0.773 . . . . 0.0 110.645 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.98 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.52 123.93 17.89 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.547 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -112.09 128.72 56.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.773 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.567 ' HG2' ' HG2' ' B' ' 54' ' ' LYS . 3.3 mt-10 -72.34 -76.32 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.819 0.342 . . . . 0.0 110.882 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 73.08 3.9 4.79 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.956 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . 0.838 ' HB3' ' HB2' ' B' ' 52' ' ' CYS . 22.5 t70 -111.17 -1.66 16.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.81 0.814 . . . . 0.0 108.985 178.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.518 ' HB3' ' H ' ' A' ' 409' ' ' ASP . 0.4 OUTLIER 51.45 -139.21 0.99 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.054 -1.43 . . . . 0.0 113.047 179.027 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.518 ' H ' ' HB3' ' A' ' 408' ' ' GLU . 0.1 OUTLIER -109.38 -163.66 0.88 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.977 -178.714 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.504 ' HB3' ' HD2' ' B' ' 104' ' ' LYS . 2.1 p30 . . . . . 0 C--O 1.253 1.271 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.978 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.4 tpt . . . . . 0 N--CA 1.481 1.087 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . 0.626 ' HB3' ' HB2' ' B' ' 40' ' ' ARG . . . -111.28 178.05 4.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.73 -0.214 . . . . 0.0 110.609 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.49 53.17 1.5 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.141 0.496 . . . . 0.0 111.352 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -153.57 109.88 3.33 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 21.0 m -152.02 47.07 0.77 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.992 0.425 . . . . 0.0 110.823 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -90.51 -175.33 4.42 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.439 ' O ' ' HA ' ' B' ' 27' ' ' MET . 6.0 tp10 -63.51 113.69 3.45 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.773 0.32 . . . . 0.0 110.837 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 80.2 t -82.93 115.44 25.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.035 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.447 ' HB2' HD21 ' B' ' 95' ' ' LEU . 48.5 mt -94.94 -29.06 14.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.393 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 5.7 tp -142.61 138.32 30.66 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.8 mt -121.57 121.59 64.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.692 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.1 t -112.06 149.21 14.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.819 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.533 ' O ' HG22 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.71 178.16 4.56 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.977 -179.63 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.517 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 12.7 mtpt 17.94 74.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 O-C-N 125.344 1.653 . . . . 0.0 113.727 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.533 HG22 ' O ' ' B' ' 13' ' ' LYS . 50.2 t -119.28 121.61 66.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.773 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.597 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 95.6 mtt180 -89.26 135.73 33.42 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.193 0.521 . . . . 0.0 111.464 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -130.57 106.53 8.56 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.633 ' HE2' ' OE2' ' A' ' 395' ' ' GLU . 0.5 OUTLIER 63.49 49.97 2.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.033 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.552 ' HE3' ' O ' ' A' ' 396' ' ' ASP . 0.7 OUTLIER 70.7 25.6 4.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.205 178.754 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.522 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.8 tt0 -134.96 119.5 18.07 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.089 -0.244 . . . . 0.0 111.212 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.64 153.31 43.62 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.47 -157.95 19.51 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.314 -0.469 . . . . 0.0 112.474 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -129.33 132.18 47.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.833 0.349 . . . . 0.0 110.334 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.884 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -97.43 130.95 44.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.029 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -124.05 128.43 49.33 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.888 HD11 HG12 ' B' ' 92' ' ' VAL . 22.2 mt -108.47 118.01 35.67 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.439 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.2 mpt? -98.65 165.22 11.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.026 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.8 -50.65 44.11 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.309 -0.86 . . . . 0.0 113.226 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -104.49 -3.75 23.57 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 167.2 30.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 119.421 -0.912 . . . . 0.0 112.704 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.804 HD13 HD11 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -115.9 125.66 73.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.65 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -129.92 119.02 22.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.236 0.541 . . . . 0.0 111.424 -178.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.884 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.8 t90 -112.05 133.82 53.98 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.002 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.479 ' HB3' ' CD2' ' B' ' 41' ' ' PHE . . . -115.67 135.28 22.64 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.231 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.804 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -74.1 150.84 43.52 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.576 2.184 . . . . 0.0 111.617 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -61.32 133.22 55.62 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.182 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.91 8.92 86.06 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.805 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.804 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.37 146.58 39.23 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.45 -0.441 . . . . 0.0 110.505 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . 0.453 ' OD2' ' HD2' ' B' ' 40' ' ' ARG . 2.4 p-10 -94.99 0.39 54.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.473 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.626 ' HB2' ' HB3' ' B' ' 2' ' ' ALA . 0.0 OUTLIER -136.39 151.65 49.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.104 0.478 . . . . 0.0 111.785 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.509 ' HD1' ' HB2' ' B' ' 2' ' ' ALA . 35.5 m-85 -82.24 121.77 27.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.393 -0.821 . . . . 0.0 108.94 178.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.2 p -86.5 -19.8 28.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.162 0.506 . . . . 0.0 110.3 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.786 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 49.5 mm -108.63 110.68 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.803 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 7.5 t -137.69 101.6 4.51 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -129.13 144.24 51.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.045 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.464 ' O ' HG12 ' B' ' 50' ' ' ILE . 76.6 mmm -88.58 143.94 26.63 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.705 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -61.82 -18.97 61.95 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.89 -15.02 60.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.506 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.623 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.69 -6.02 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 109.983 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.653 ' HB ' HD21 ' B' ' 100' ' ' LEU . 1.9 mm -90.42 129.23 41.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.45 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 11.2 ttpt -86.32 -33.44 20.6 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.24 0.543 . . . . 0.0 109.825 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.838 ' HB2' ' HB3' ' A' ' 407' ' ' ASP . 27.5 p -178.38 -178.16 0.6 Allowed 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.089 -0.96 . . . . 0.0 108.638 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . 0.456 ' OE1' HD13 ' B' ' 100' ' ' LEU . 5.4 pm0 -134.89 140.94 46.18 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.996 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.107 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 47.1 mttp -102.2 145.29 29.62 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.353 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.51 HD13 ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -124.15 129.39 74.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.099 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 176.677 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' SER . . . . . 0.492 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -90.17 117.52 68.12 Favored Pre-proline 0 C--O 1.251 1.138 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.59 173.03 10.49 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 125.165 3.91 . . . . 0.0 114.441 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.7 mp0 -61.12 160.48 10.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.069 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.76 -28.94 8.13 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.949 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.8 mttp -87.79 152.8 21.84 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.65 -20.34 66.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.228 0.537 . . . . 0.0 110.322 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.723 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.1 OUTLIER -135.48 144.0 46.15 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.923 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.644 HG21 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -85.44 142.36 13.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.516 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 21.0 mt-30 -141.01 163.51 32.78 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.404 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -141.96 153.46 44.34 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.039 -1.437 . . . . 0.0 108.04 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.107 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.71 146.03 30.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 119.045 0.839 . . . . 0.0 110.678 178.18 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.804 HD11 HD13 ' B' ' 31' ' ' ILE . 55.7 mt -97.19 106.65 19.01 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.149 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.586 ' HA ' HG21 ' B' ' 74' ' ' THR . 14.1 t -91.72 124.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.457 HD21 HD12 ' B' ' 50' ' ' ILE . 5.5 mt -108.08 153.91 22.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.022 0.439 . . . . 0.0 112.151 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.623 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -76.06 -5.48 46.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.768 0.794 . . . . 0.0 108.977 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.2 -4.64 48.67 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.6 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.26 20.68 51.77 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.465 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . 0.441 ' HB3' HD12 ' B' ' 69' ' ' LEU . 23.5 t70 -126.2 160.47 30.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.561 -0.32 . . . . 0.0 110.509 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.586 HG21 ' HA ' ' B' ' 68' ' ' VAL . 15.8 p -141.65 131.22 23.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.048 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 10.5 m -110.21 104.17 12.96 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.106 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -82.26 153.58 25.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.235 0.54 . . . . 0.0 112.206 -178.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.786 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 64.5 m-85 -140.02 111.31 7.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.857 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.597 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.78 112.01 21.29 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.772 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 20.6 m-85 -76.91 92.52 3.66 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.2 9.16 34.88 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.517 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 52.2 t30 -84.76 92.75 8.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.03 0.443 . . . . 0.0 110.238 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -49.85 -32.0 13.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.678 -178.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.99 -60.63 3.02 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -178.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.475 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.7 p -128.27 14.19 6.67 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.772 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.96 -46.02 10.85 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.413 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.56 -54.52 33.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.475 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -64.66 -37.64 88.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.229 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.718 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 14.2 mt-10 -65.5 -45.17 84.61 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.278 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.644 ' HD3' HG21 ' B' ' 63' ' ' ILE . 19.2 ttp180 -54.99 -47.02 75.18 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.03 -44.96 95.59 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 113.536 -1.665 . . . . 0.0 112.568 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.93 -42.09 81.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 117.841 0.291 . . . . 0.0 111.073 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.888 HG12 HD11 ' B' ' 26' ' ' LEU . 34.0 t -62.41 -42.21 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.17 -56.2 25.18 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.579 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.09 -52.59 63.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.087 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.776 ' HG ' HD12 ' B' ' 99' ' ' LEU . 15.1 tp -61.96 -42.54 99.24 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.038 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.537 HD13 HG13 ' B' ' 92' ' ' VAL . 19.1 mt -68.23 -43.47 77.88 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.73 -21.31 65.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.361 1.077 . . . . 0.0 109.347 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.42 -50.93 6.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.164 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.776 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.8 mt -74.28 -50.88 17.08 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 113.452 -1.704 . . . . 0.0 114.675 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.705 HD23 ' HB3' ' B' ' 47' ' ' TYR . 40.5 mt -49.87 -57.53 12.12 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.602 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 62.2 Cg_exo -54.84 -16.92 12.51 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.614 2.209 . . . . 0.0 114.076 -179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -87.52 -13.65 42.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.754 0.312 . . . . 0.0 110.945 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.491 ' O ' ' HD3' ' B' ' 105' ' ' ARG . 70.4 m-85 -121.37 -29.85 4.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.793 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' B' ' 100' ' ' LEU . 52.9 pttt -85.03 124.8 32.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.203 0.525 . . . . 0.0 111.158 -179.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . 0.491 ' HD3' ' O ' ' B' ' 103' ' ' PHE . 0.0 OUTLIER -150.83 116.03 5.35 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.873 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -64.83 -37.87 89.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.712 0.291 . . . . 0.0 111.551 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -143.23 61.78 1.39 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.782 0.325 . . . . 0.0 111.001 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 0.999 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.415 ' HB2' ' H ' ' A' ' 393' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . 0.415 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 6.4 m -67.4 142.05 17.05 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 82.16 -67.31 3.71 Favored Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.727 ' HG2' ' H ' ' B' ' 76' ' ' ASN . 2.9 tp10 -108.1 95.99 6.06 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.111 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -98.22 29.66 3.45 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.37 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.474 ' HA ' ' HD3' ' B' ' 19' ' ' LYS . 12.2 t70 -41.3 -43.03 2.33 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 3.1 tt0 175.19 -96.13 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.923 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.1 tt0 -117.54 99.71 7.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.463 -177.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.49 ' HB2' ' CD2' ' A' ' 403' ' ' PHE . 9.4 p-10 -135.64 92.1 2.79 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.351 0.596 . . . . 0.0 112.241 -177.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.534 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.3 p-10 -139.48 -46.99 0.46 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -73.14 11.56 0.7 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.786 0.803 . . . . 0.0 110.44 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.842 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -55.49 116.14 2.71 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.39 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -100.57 131.04 46.69 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.611 ' HA ' ' HA ' ' B' ' 54' ' ' LYS . 2.5 tt0 -81.12 -69.93 0.57 Allowed 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -177.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 85.64 -27.42 0.09 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.765 0.826 . . . . 0.0 109.01 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . 0.48 ' HB3' ' CB ' ' B' ' 52' ' ' CYS . 0.2 OUTLIER -79.39 -36.25 39.48 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 176.484 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 62.41 -159.92 0.31 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 113.83 -1.532 . . . . 0.0 112.792 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -76.27 69.5 2.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.759 -178.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.483 ' OXT' ' HE3' ' B' ' 106' ' ' LYS . 26.4 t70 . . . . . 0 C--O 1.243 0.744 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.723 ' HG3' ' HB2' ' B' ' 6' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.938 0 CA-C-O 120.364 0.126 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.8 -146.28 0.14 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.889 0.376 . . . . 0.0 110.692 -179.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.79 78.16 8.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.618 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 13.3 m 66.08 52.9 1.13 Allowed 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 121.553 0.692 . . . . 0.0 110.441 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 14.7 m -148.93 105.38 3.53 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.412 -0.813 . . . . 0.0 108.874 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.723 ' HB2' ' HG3' ' B' ' 1' ' ' MET . 70.3 mm-40 72.59 36.4 0.99 Allowed 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -178.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.59 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -89.12 101.72 14.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.25 -179.784 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 95.5 t -82.01 115.88 25.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.048 0.451 . . . . 0.0 110.246 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.401 ' HB2' HD23 ' B' ' 95' ' ' LEU . 25.7 mt -97.53 -29.75 13.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.841 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.0 tp -139.5 140.4 37.2 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 79.4 mt -122.59 121.94 64.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.75 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.3 t -111.96 148.21 15.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.929 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.589 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.03 175.68 5.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.548 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.1 79.68 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 O-C-N 125.393 1.683 . . . . 0.0 113.61 -179.62 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.589 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.6 t -130.74 126.98 61.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 114.878 -1.056 . . . . 0.0 108.957 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.58 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 9.2 mtm180 -95.16 144.87 25.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.597 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.8 110.33 6.68 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.433 ' NZ ' ' HA ' ' A' ' 395' ' ' GLU . 13.0 tppt? 67.82 52.19 0.74 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.627 0.727 . . . . 0.0 110.003 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.474 ' HD3' ' HA ' ' A' ' 397' ' ' ASP . 0.3 OUTLIER 62.89 25.28 14.99 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.869 178.107 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.568 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.6 pt20 -138.32 131.72 30.49 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.98 -0.45 . . . . 0.0 110.263 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -82.72 153.52 25.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -177.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.11 -154.77 12.42 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.914 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 136.65 50.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.085 0.469 . . . . 0.0 110.077 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.912 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.44 141.79 30.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.938 -178.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 40.2 m-85 -133.19 122.54 24.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.846 HD11 HG13 ' B' ' 92' ' ' VAL . 19.6 mt -104.34 120.67 41.71 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.8 -178.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.59 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.3 mpt? -100.99 161.61 13.47 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.19 -20.41 65.39 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -107.78 -20.2 13.29 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -161.9 167.67 24.28 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.824 -176.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.854 HD13 HD12 ' B' ' 67' ' ' LEU . 1.1 tt -109.65 117.71 55.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -119.05 152.65 36.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.969 0.414 . . . . 0.0 110.752 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.912 ' HB2' HD12 ' B' ' 24' ' ' LEU . 38.3 t90 -147.32 140.78 25.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -125.51 138.16 31.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.944 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -68.33 153.6 73.89 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.644 2.229 . . . . 0.0 111.374 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -65.23 116.01 6.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.964 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.96 4.1 54.48 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.432 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.544 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -97.36 143.22 28.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.582 0.706 . . . . 0.0 111.253 179.762 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . 0.422 ' CG ' ' HZ2' ' B' ' 38' ' ' LYS . 0.4 OUTLIER -83.63 -14.29 52.28 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.494 -179.533 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.42 156.81 45.23 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.939 0.399 . . . . 0.0 111.463 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -75.69 131.49 39.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.187 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -92.61 -28.93 16.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.442 0.639 . . . . 0.0 109.752 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.755 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 16.7 mm -97.57 123.84 50.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.404 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 31.2 t -147.99 101.45 3.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.472 ' CD2' HG21 ' B' ' 43' ' ' ILE . 85.0 m-70 -124.61 128.74 49.35 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.67 0.272 . . . . 0.0 110.816 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.522 ' O ' HG12 ' B' ' 50' ' ' ILE . 0.0 OUTLIER -78.96 139.72 38.17 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.869 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.564 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -58.84 -24.32 61.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.65 -8.74 57.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.57 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.577 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.9 OUTLIER -111.63 -10.14 14.12 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.282 0.563 . . . . 0.0 110.289 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.736 ' HB ' HD21 ' B' ' 100' ' ' LEU . 1.1 mm -91.94 130.2 41.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 11.1 tttp -89.78 -46.25 8.72 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.435 0.636 . . . . 0.0 110.08 -179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.53 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -155.95 -177.88 6.9 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.679 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -146.48 143.11 28.74 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.713 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.105 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 46.2 mttp -108.76 156.62 19.41 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.985 0.421 . . . . 0.0 110.123 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.502 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.9 OUTLIER -132.11 130.04 60.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 176.27 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' SER . . . . . 0.511 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.36 117.81 68.54 Favored Pre-proline 0 C--O 1.25 1.121 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.19 173.45 12.21 Favored 'Trans proline' 0 C--N 1.344 0.298 1 C-N-CA 125.357 4.038 . . . . 0.0 114.544 -177.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.68 160.56 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.09 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.85 -29.27 7.89 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.923 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.9 mttp -91.34 150.58 21.23 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.28 -4.24 21.03 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.134 0.492 . . . . 0.0 110.742 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.81 143.94 33.68 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.756 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.636 HG21 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -90.55 136.62 23.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.511 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 13.8 mt-30 -138.17 163.35 31.9 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -141.09 154.03 45.74 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.184 -1.371 . . . . 0.0 107.964 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.105 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.71 143.67 28.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 118.927 0.785 . . . . 0.0 111.21 178.368 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.854 HD12 HD13 ' B' ' 31' ' ' ILE . 77.4 mt -96.02 109.77 22.12 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.138 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.558 ' HA ' HG23 ' B' ' 74' ' ' THR . 4.7 t -95.41 108.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.499 HD23 HD13 ' B' ' 50' ' ' ILE . 4.1 mt -92.06 156.17 17.58 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.045 0.45 . . . . 0.0 112.008 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.577 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -80.18 1.13 29.44 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.347 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.49 -7.61 59.63 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.251 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.0 17.56 47.03 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.745 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.22 159.37 33.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.7 0.286 . . . . 0.0 110.711 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.575 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 20.8 p -135.35 130.86 35.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.885 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.532 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.18 102.42 11.56 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.367 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.727 ' H ' ' HG2' ' A' ' 395' ' ' GLU . 4.0 m-20 -82.22 142.72 31.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.465 0.65 . . . . 0.0 111.742 -178.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.755 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 52.2 m-85 -126.79 115.25 19.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.206 179.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.584 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 6.0 t60 -87.2 110.64 20.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.866 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.821 ' HB3' ' HB2' ' B' ' 85' ' ' ALA . 26.8 m-85 -81.56 93.23 6.66 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.1 4.02 52.86 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.548 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -81.79 91.27 6.47 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 121.212 0.53 . . . . 0.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.7 -39.95 5.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.423 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -59.64 4.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.467 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.1 p -127.61 10.43 6.64 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.821 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -44.47 -46.86 9.88 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.406 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.99 -53.88 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.84 0.352 . . . . 0.0 110.772 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.467 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 3.8 mttt -65.49 -35.89 82.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.057 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.753 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.5 mt-10 -65.37 -47.26 77.0 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.636 ' HD3' HG21 ' B' ' 63' ' ' ILE . 22.3 ttp180 -54.43 -47.57 72.66 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.015 0.912 . . . . 0.0 108.596 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.39 -45.73 91.8 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.662 -1.608 . . . . 0.0 112.357 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.14 -40.71 90.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.909 0.322 . . . . 0.0 110.998 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.846 HG13 HD11 ' B' ' 26' ' ' LEU . 40.9 t -62.92 -43.45 98.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 177.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.76 -55.38 35.88 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.588 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -53.46 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.463 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.852 ' HG ' HD11 ' B' ' 99' ' ' LEU . 12.7 tp -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.272 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.431 HD12 HG11 ' B' ' 92' ' ' VAL . 30.9 mt -71.01 -47.75 57.03 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 117.663 0.21 . . . . 0.0 110.981 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.41 -17.83 63.08 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.76 0.791 . . . . 0.0 109.757 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -88.3 -48.45 7.66 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.863 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.852 HD11 ' HG ' ' B' ' 95' ' ' LEU . 9.9 mt -79.29 -47.46 15.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.087 -1.415 . . . . 0.0 114.538 -177.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.736 HD21 ' HB ' ' B' ' 50' ' ' ILE . 26.5 mt -49.81 -53.88 37.74 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 17.4 Cg_endo -57.45 -18.52 31.94 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.332 2.021 . . . . 0.0 113.4 -179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -87.58 -8.52 56.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.715 0.293 . . . . 0.0 111.292 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -125.3 -6.01 7.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.328 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.554 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 75.3 mttt -59.43 109.08 0.81 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.985 0.421 . . . . 0.0 111.356 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 13.9 ptt-85 -80.74 63.98 5.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.35 0.595 . . . . 0.0 111.002 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.483 ' HE3' ' OXT' ' A' ' 410' ' ' ASP . 0.7 OUTLIER -115.0 145.41 42.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.189 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -102.16 20.06 17.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.145 0.497 . . . . 0.0 110.52 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.6 t30 . . . . . 0 C--O 1.245 0.851 0 CA-C-N 114.966 -1.016 . . . . 0.0 108.985 -179.856 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 14.7 p -170.24 142.2 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 70.33 -113.36 4.84 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.116 -0.793 . . . . 0.0 111.116 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.819 ' HG2' ' HB2' ' B' ' 76' ' ' ASN . 7.0 tp10 -100.46 144.44 29.45 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -135.27 29.63 3.33 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.138 -178.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.551 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 5.8 t70 -61.85 -33.93 75.06 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.437 -178.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.671 ' HB3' ' HZ1' ' B' ' 62' ' ' LYS . 1.6 tt0 169.77 -69.54 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 O-C-N 123.168 0.293 . . . . 0.0 111.364 178.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.64 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER -148.11 114.78 6.01 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.435 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 3.9 m-20 -139.83 87.48 2.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.547 ' C ' ' H ' ' A' ' 403' ' ' PHE . 1.3 p30 -138.45 -48.62 0.53 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -67.98 6.89 0.62 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.636 0.732 . . . . 0.0 110.637 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.893 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.56 120.3 7.52 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.766 179.107 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -104.94 131.72 52.08 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.78 -178.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 1.044 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 6.8 pt-20 -137.3 -166.38 1.92 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.225 0.536 . . . . 0.0 111.374 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -138.82 150.68 46.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.662 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -78.86 14.36 1.39 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.928 0.394 . . . . 0.0 111.458 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.419 ' HG3' ' HB3' ' B' ' 52' ' ' CYS . 5.2 pt-20 -50.61 98.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.808 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.72 -41.52 9.65 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.443 ' CG ' ' HZ2' ' B' ' 104' ' ' LYS . 3.3 t0 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.825 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 7.7 tpt . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 121.162 0.506 . . . . 0.0 109.994 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.08 87.53 1.61 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.2 m 64.85 33.21 10.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 122.028 0.918 . . . . 0.0 108.565 -177.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -143.81 91.59 2.25 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.879 -178.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 4.1 m 61.32 74.77 0.43 Allowed 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.378 0.608 . . . . 0.0 109.536 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.52 2.42 11.23 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.96 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.557 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.7 OUTLIER -81.92 101.64 10.38 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.315 -1.311 . . . . 0.0 109.769 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.491 HG21 ' HE1' ' B' ' 27' ' ' MET . 96.3 t -82.36 116.27 26.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.126 -178.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 34.7 mt -91.37 -33.3 15.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.181 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tp -131.21 127.48 37.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.992 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 71.1 mt -110.21 124.25 66.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.842 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.4 t -115.65 150.24 17.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.331 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.597 ' O ' HG21 ' B' ' 15' ' ' VAL . 1.5 mtmp? -115.47 178.0 4.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.3 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.571 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.44 70.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 O-C-N 125.294 1.621 . . . . 0.0 113.245 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.597 HG21 ' O ' ' B' ' 13' ' ' LYS . 19.7 t -119.1 131.26 72.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.022 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.694 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 98.9 mtt180 -101.96 139.2 37.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.316 0.579 . . . . 0.0 111.301 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.554 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -134.84 109.57 8.61 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.968 -1.014 . . . . 0.0 108.728 179.039 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.95 41.43 6.58 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.477 0.485 . . . . 0.0 110.914 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.551 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 4.1 tptp 73.95 27.3 1.65 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.548 179.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.694 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 35.8 mt-30 -125.82 124.24 40.49 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -85.78 139.36 31.38 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.013 0.196 . . . . 0.0 110.798 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.518 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -172.96 -153.71 9.74 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.51 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.29 137.85 52.93 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.911 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.61 142.28 33.21 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.736 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -136.44 120.68 17.9 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.84 HD12 HG11 ' B' ' 92' ' ' VAL . 15.2 mt -100.27 120.66 40.26 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.636 -0.425 . . . . 0.0 111.28 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.557 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.6 mpt? -96.51 166.91 11.46 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.12 66.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.404 ' CD ' ' HZ2' ' B' ' 106' ' ' LYS . 1.4 mt-10 -116.62 -0.89 12.28 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.446 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 16.8 ptt180 -157.13 158.69 36.81 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 119.158 -1.017 . . . . 0.0 112.699 -177.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.974 HD12 HD12 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -110.39 121.62 63.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.73 178.658 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.423 ' HB1' ' HE3' ' B' ' 27' ' ' MET . . . -122.85 150.43 42.88 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.038 0.447 . . . . 0.0 110.662 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.911 ' HB2' HD11 ' B' ' 24' ' ' LEU . 31.1 t90 -146.99 139.83 25.1 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.419 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -131.1 137.52 30.88 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.518 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 22.1 Cg_exo -64.52 160.93 37.27 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.515 2.143 . . . . 0.0 111.515 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.44 131.26 50.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.191 0.519 . . . . 0.0 111.358 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.01 29.85 68.51 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.078 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.426 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 21.8 mmtm -113.7 147.55 37.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 117.023 0.412 . . . . 0.0 110.46 179.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -96.32 -14.65 22.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.044 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -124.02 146.7 48.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.45 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -83.57 121.83 27.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.818 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.1 p -83.81 -21.13 32.2 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.262 0.553 . . . . 0.0 110.411 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.783 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 10.3 mm -106.28 124.39 61.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.56 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 42.3 t -147.78 101.45 3.32 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.827 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.509 ' CD2' HG21 ' B' ' 43' ' ' ILE . 73.4 m-70 -129.94 139.13 51.15 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.515 ' O ' HG12 ' B' ' 50' ' ' ILE . 79.6 mmm -92.4 142.77 27.06 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.726 ' HB3' HD21 ' B' ' 100' ' ' LEU . 21.7 m-85 -59.18 -21.3 59.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.25 0.548 . . . . 0.0 109.817 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . 0.613 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -68.38 -22.75 64.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.144 -0.935 . . . . 0.0 112.185 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.57 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -102.54 -10.92 18.91 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.999 0.428 . . . . 0.0 110.771 -179.426 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.704 ' HB ' HD22 ' B' ' 100' ' ' LEU . 0.9 OUTLIER -86.35 132.45 32.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.678 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -92.72 -55.34 3.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.609 0.719 . . . . 0.0 109.964 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.485 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -144.52 -177.45 5.5 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . 0.637 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 6.3 pt20 -141.87 145.85 35.1 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.694 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.047 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 49.3 mttp -107.16 147.05 30.59 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 177.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.665 ' HB ' ' HD3' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.92 123.46 62.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 176.365 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -88.97 120.27 69.94 Favored Pre-proline 0 C--O 1.245 0.868 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -69.53 172.69 11.96 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 124.415 3.41 . . . . 0.0 113.968 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.46 161.29 12.04 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.203 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.85 -28.96 7.75 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.64 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 6.4 mttp -85.24 161.36 19.6 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 175.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.02 -16.75 64.18 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.357 0.599 . . . . 0.0 110.496 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.671 ' HZ1' ' HB3' ' A' ' 398' ' ' GLU . 0.0 OUTLIER -140.05 150.37 44.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.415 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.6 ' O ' ' HB2' ' B' ' 79' ' ' PHE . 4.1 mp -89.11 135.09 26.73 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.421 HE21 ' HB2' ' B' ' 64' ' ' GLN . 7.0 mt-30 -134.35 162.95 30.79 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -175.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.737 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -140.0 153.62 46.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.968 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.047 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.45 145.51 30.24 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 119.232 0.924 . . . . 0.0 110.72 178.26 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.974 HD12 HD12 ' B' ' 31' ' ' ILE . 95.6 mt -94.74 109.08 21.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.421 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.489 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.0 t -95.36 108.72 21.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.536 HD22 HD11 ' B' ' 50' ' ' ILE . 5.2 mt -88.77 155.83 19.33 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.102 -177.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.57 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -79.23 -1.58 37.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.666 0.746 . . . . 0.0 109.034 178.294 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -5.91 58.71 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.584 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.5 20.45 44.65 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.556 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . 0.521 ' HB3' HD11 ' B' ' 69' ' ' LEU . 19.1 t70 -126.14 160.86 29.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.62 -0.29 . . . . 0.0 110.279 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.527 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 17.5 p -138.23 131.21 29.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.459 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.53 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.8 m -110.46 102.77 11.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.819 ' HB2' ' HG2' ' A' ' 395' ' ' GLU . 3.2 m-20 -82.99 144.63 29.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.552 0.691 . . . . 0.0 112.303 -177.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.783 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 46.5 m-85 -129.59 107.32 9.36 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.564 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.564 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.98 112.43 21.82 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.639 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.737 ' HE1' ' HB2' ' B' ' 65' ' ' LEU . 81.3 m-85 -83.56 95.98 8.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.92 5.47 51.56 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.571 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.4 t-20 -87.23 91.45 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.915 0.388 . . . . 0.0 110.015 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.06 -39.28 9.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.923 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.91 -59.44 4.33 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.507 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.61 10.41 6.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.505 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -44.99 -48.5 11.47 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.246 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.587 HG22 HG12 ' B' ' 63' ' ' ILE . 4.8 t -57.63 -52.14 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.15 0.5 . . . . 0.0 110.685 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.507 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.6 mttt -68.72 -33.63 74.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.595 ' HB3' ' CE2' ' B' ' 79' ' ' PHE . 11.3 mt-10 -65.79 -43.53 88.49 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.665 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 6.1 ttm105 -57.73 -43.71 85.51 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 177.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.22 -44.76 87.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.289 -1.323 . . . . 0.0 112.758 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.06 -45.11 74.77 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 117.784 0.266 . . . . 0.0 111.451 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.84 HG11 HD12 ' B' ' 26' ' ' LEU . 44.4 t -60.69 -43.19 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.637 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.4 ttpm? -59.27 -55.01 40.33 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.821 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -53.84 -54.33 39.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.474 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.659 ' HG ' HD13 ' B' ' 99' ' ' LEU . 12.2 tp -61.76 -41.71 98.05 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.349 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.514 HD12 HG12 ' B' ' 92' ' ' VAL . 22.1 mt -69.29 -44.62 71.42 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 117.876 0.307 . . . . 0.0 110.221 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . 0.467 ' N ' HE22 ' B' ' 53' ' ' GLN . 5.8 tp-100 -62.0 -24.28 66.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.233 1.016 . . . . 0.0 109.079 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.461 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 2.0 mm-40 -84.97 -44.76 12.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.299 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.665 HD12 ' CE2' ' B' ' 47' ' ' TYR . 20.4 mt -81.06 -47.07 14.05 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.726 HD21 ' HB3' ' B' ' 47' ' ' TYR . 34.6 mt -50.15 -56.77 15.64 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -176.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.564 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 52.4 Cg_exo -57.09 -22.32 46.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.407 2.071 . . . . 0.0 114.094 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' B' ' 98' ' ' GLN . 12.2 mtpt -88.53 -10.93 47.2 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.613 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 71.4 m-85 -127.08 7.94 6.64 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.677 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.512 ' O ' ' HD2' ' B' ' 104' ' ' LYS . 0.0 OUTLIER -55.05 128.23 32.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.17 0.509 . . . . 0.0 112.034 -179.127 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 41.0 mtt-85 58.85 21.35 8.97 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.302 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.436 ' HE3' ' HB3' ' B' ' 106' ' ' LYS . 0.7 OUTLIER -83.23 78.89 9.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.972 0.415 . . . . 0.0 110.147 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -81.18 55.28 2.48 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.958 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.075 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.51 ' H2 ' ' CG ' ' A' ' 400' ' ' ASP . 5.2 t80 . . . . . 0 N--CA 1.476 0.864 0 CA-C-O 121.392 0.615 . . . . 0.0 110.316 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 50.7 t -132.75 115.87 25.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 81.83 -57.67 4.93 Favored Glycine 0 N--CA 1.45 -0.405 0 N-CA-C 109.829 -1.309 . . . . 0.0 109.829 -177.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.575 ' HG2' ' HB2' ' B' ' 76' ' ' ASN . 7.8 tp10 -111.95 148.31 34.02 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.567 ' C ' ' H ' ' A' ' 398' ' ' GLU . 3.3 p30 -109.16 30.14 6.86 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.714 -0.221 . . . . 0.0 111.5 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.544 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 0.8 OUTLIER -64.3 16.88 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.641 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.567 ' H ' ' C ' ' A' ' 396' ' ' ASP . 47.1 mt-10 96.16 -77.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.606 1.562 . . . . 0.0 111.906 178.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.902 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.0 OUTLIER -108.97 143.85 37.7 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.316 -177.807 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.51 ' CG ' ' H2 ' ' A' ' 392' ' ' TYR . 3.6 p-10 177.7 77.12 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.052 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.578 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.04 -54.2 0.58 Allowed 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -177.621 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . 0.403 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 3.9 p30 -69.9 11.5 0.29 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.728 0.775 . . . . 0.0 110.555 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.964 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.53 126.28 25.85 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.858 179.352 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -112.92 122.34 47.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.714 -178.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.583 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 3.2 pt-20 -107.28 -29.96 9.0 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.065 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 79.23 -37.02 0.18 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.769 0.828 . . . . 0.0 110.545 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -78.6 -35.21 46.04 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.466 ' HB2' ' H ' ' A' ' 409' ' ' ASP . 5.9 mm-40 51.84 -103.04 0.14 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.316 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.466 ' H ' ' HB2' ' A' ' 408' ' ' GLU . 1.1 t0 -178.82 152.71 0.61 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.492 -0.776 . . . . 0.0 108.93 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 27.7 t70 . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.659 -0.686 . . . . 0.0 109.769 -179.23 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 77.7 mtm . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 120.512 0.196 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.23 127.75 0.35 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.28 51.97 0.57 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.351 0.596 . . . . 0.0 111.586 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -158.38 -47.24 0.06 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.309 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 14.8 m -155.28 154.66 32.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.321 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 67.82 42.77 1.88 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.464 0.65 . . . . 0.0 110.374 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.433 ' O ' ' HA ' ' B' ' 27' ' ' MET . 1.4 tp10 -106.32 122.72 46.81 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.37 178.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.605 HG21 ' HE1' ' B' ' 27' ' ' MET . 49.0 t -82.89 121.8 36.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 115.217 -0.902 . . . . 0.0 111.605 -177.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.1 mt -97.37 -30.39 12.96 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.476 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 8.5 tp -131.76 127.31 36.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.837 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.413 HG23 ' CE1' ' B' ' 25' ' ' TYR . 75.8 mt -111.78 121.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.814 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -111.21 149.9 13.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.215 -179.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.577 ' O ' HG22 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.65 176.94 4.86 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.841 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.541 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.0 mtpm? 18.17 72.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 O-C-N 125.352 1.657 . . . . 0.0 113.527 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.577 HG22 ' O ' ' B' ' 13' ' ' LYS . 18.6 t -119.83 124.52 72.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.577 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.568 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 4.8 mtp180 -89.19 120.21 30.37 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.179 0.514 . . . . 0.0 111.252 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.617 ' HG2' HG13 ' B' ' 43' ' ' ILE . 28.1 tp60 -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.21 37.57 2.08 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.487 ' HD3' ' HA ' ' A' ' 397' ' ' ASP . 0.0 OUTLIER 68.24 23.81 7.68 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.336 179.882 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.534 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.2 tt0 -126.21 120.77 30.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.326 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.57 153.29 43.03 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.758 0.313 . . . . 0.0 111.808 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.413 ' HA2' ' N ' ' B' ' 36' ' ' GLU . . . 178.08 -154.9 15.83 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.783 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.98 132.87 49.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.997 0.427 . . . . 0.0 110.387 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.827 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -99.01 143.13 29.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.54 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . 0.413 ' CE1' HG23 ' B' ' 11' ' ' ILE . 66.5 m-85 -134.28 124.42 25.85 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.938 HD11 HG11 ' B' ' 92' ' ' VAL . 17.3 mt -105.13 110.17 22.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.349 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.605 ' HE1' HG21 ' B' ' 8' ' ' VAL . 2.2 mpt? -89.46 162.58 15.66 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.47 -23.64 62.9 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -116.23 -12.56 11.16 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -159.57 166.64 30.34 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 119.703 -0.799 . . . . 0.0 112.73 -176.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.999 HD12 HD12 ' B' ' 67' ' ' LEU . 1.1 tt -112.21 119.41 60.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.835 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.54 ' HB3' ' HE3' ' B' ' 27' ' ' MET . . . -120.16 151.89 38.44 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.328 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.827 ' HB2' HD11 ' B' ' 24' ' ' LEU . 27.1 t90 -146.9 139.77 25.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -124.76 143.87 44.94 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.274 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.527 ' O ' ' HB2' ' B' ' 38' ' ' LYS . 28.3 Cg_exo -61.85 159.95 31.28 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.476 2.118 . . . . 0.0 111.662 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.413 ' N ' ' HA2' ' B' ' 22' ' ' GLY . 5.3 tp10 -57.34 130.52 46.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.21 0.529 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.0 29.81 75.75 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.031 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.527 ' HB2' ' O ' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.15 151.28 31.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.056 0.428 . . . . 0.0 110.843 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -98.65 -22.08 16.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.013 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -108.67 140.92 41.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.651 -178.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -84.74 124.59 31.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.011 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.4 p -92.58 -13.65 29.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.281 0.562 . . . . 0.0 110.594 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.727 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -114.09 124.89 71.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.135 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.0 t -147.81 102.84 3.45 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -124.5 137.41 54.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.487 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.7 mmm -89.16 138.89 31.02 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.691 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.7 m-85 -56.97 -24.39 52.82 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.301 0.572 . . . . 0.0 110.358 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.27 -32.65 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.614 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.563 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -91.58 -11.87 36.0 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 123.538 0.524 . . . . 0.0 111.604 -178.272 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.664 ' HB ' HD21 ' B' ' 100' ' ' LEU . 1.5 mm -83.57 135.69 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 18.0 ttpp -87.18 -47.69 8.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 4.7 p -167.73 -177.77 3.6 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.318 -1.31 . . . . 0.0 108.273 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -135.05 144.04 47.05 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.616 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.022 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 48.1 mttp -102.16 148.31 25.56 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.515 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.7 OUTLIER -125.78 127.84 71.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 176.542 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.9 p -91.3 115.62 64.78 Favored Pre-proline 0 C--O 1.25 1.111 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -67.6 173.14 9.36 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 125.125 3.883 . . . . 0.0 114.042 -177.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -59.28 160.05 7.01 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.123 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.52 -29.05 8.13 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.534 -1.427 . . . . 0.0 109.534 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.61 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 5.1 mttm -86.9 153.18 21.81 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.37 -16.21 64.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.242 0.544 . . . . 0.0 110.493 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.902 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.31 138.38 38.31 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.926 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.624 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -80.34 131.61 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.54 162.91 30.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -176.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.671 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -140.38 153.89 46.52 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.068 -1.424 . . . . 0.0 107.719 177.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.022 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -145.7 142.43 28.98 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.973 0.806 . . . . 0.0 110.483 178.176 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.999 HD12 HD12 ' B' ' 31' ' ' ILE . 39.8 mt -94.0 106.94 18.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.024 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.501 HG23 ' OE2' ' A' ' 405' ' ' GLU . 8.1 t -94.24 113.84 29.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.042 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.53 HD21 HD13 ' B' ' 50' ' ' ILE . 3.2 mt -98.36 158.9 15.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.021 0.439 . . . . 0.0 112.066 -177.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.563 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -81.18 0.02 38.38 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.297 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.67 -3.47 56.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.531 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.91 19.96 56.68 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . 0.406 ' HB3' HD11 ' B' ' 69' ' ' LEU . 18.9 t70 -126.04 157.41 38.01 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.559 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.528 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 20.3 p -137.15 130.86 31.74 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.53 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 0.8 OUTLIER -107.96 105.34 15.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.157 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.575 ' HB2' ' HG2' ' A' ' 395' ' ' GLU . 5.2 m-20 -86.36 128.46 34.94 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 112.534 -177.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.727 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 50.3 m-85 -114.32 110.03 19.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.397 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.568 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.5 t-160 -86.82 113.35 22.56 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.026 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.671 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 46.0 m-85 -80.18 92.33 5.68 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.31 27.66 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.926 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.541 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -107.14 91.33 3.61 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -35.51 4.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.19 -0.914 . . . . 0.0 113.337 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 57.1 m -58.88 -59.99 4.57 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.503 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.8 p -127.9 9.99 6.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.658 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -42.8 -50.15 5.68 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 113.863 1.061 . . . . 0.0 113.863 -177.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.463 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.92 -52.79 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.909 0.385 . . . . 0.0 110.992 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.503 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -66.73 -35.49 80.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.138 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.636 ' O ' HG22 ' B' ' 92' ' ' VAL . 12.3 mt-10 -64.97 -45.46 85.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.624 ' HD3' HG23 ' B' ' 63' ' ' ILE . 20.6 ttp180 -55.22 -47.51 75.24 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.5 -45.27 93.77 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.799 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.7 -42.44 82.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 117.843 0.292 . . . . 0.0 111.26 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.938 HG11 HD11 ' B' ' 26' ' ' LEU . 45.8 t -62.36 -42.26 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -53.46 58.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.69 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -57.82 -54.65 44.46 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.045 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.89 ' HG ' HD11 ' B' ' 99' ' ' LEU . 13.1 tp -60.67 -40.33 91.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.137 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.477 HD12 HG12 ' B' ' 92' ' ' VAL . 22.7 mt -69.72 -45.86 67.24 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.729 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -65.03 -18.39 65.26 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.745 0.783 . . . . 0.0 109.544 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 33.4 mm-40 -84.79 -50.86 7.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.981 178.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.89 HD11 ' HG ' ' B' ' 95' ' ' LEU . 9.3 mt -78.41 -45.91 21.18 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.691 HD23 ' HB3' ' B' ' 47' ' ' TYR . 32.7 mt -51.58 -51.23 71.58 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -176.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.403 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 45.4 Cg_endo -67.36 -24.96 42.57 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.198 1.932 . . . . 0.0 114.341 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 32.3 mttm -63.82 -31.67 72.93 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.003 0.43 . . . . 0.0 111.804 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -91.79 17.19 9.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.665 0.745 . . . . 0.0 110.485 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -112.55 -177.84 3.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.775 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . 0.564 ' HE ' ' HA ' ' B' ' 105' ' ' ARG . 0.0 OUTLIER -89.02 46.59 1.4 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.196 0.522 . . . . 0.0 110.748 179.841 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -156.37 110.85 2.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.599 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.13 119.04 7.08 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.546 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.519 -0.753 . . . . 0.0 109.859 -179.488 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.514 ' HE2' ' HB2' ' A' ' 395' ' ' GLU . 2.6 p90 . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.642 0.258 . . . . 0.0 110.457 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 21.1 t -94.89 99.97 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.157 0.503 . . . . 0.0 109.8 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 170.56 -45.33 0.2 Allowed Glycine 0 CA--C 1.505 -0.531 0 N-CA-C 109.444 -1.463 . . . . 0.0 109.444 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.514 ' HB2' ' HE2' ' A' ' 392' ' ' TYR . 0.0 OUTLIER -117.16 169.35 9.52 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 177.187 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.451 ' O ' ' HE3' ' B' ' 19' ' ' LYS . 32.1 t70 -136.1 31.86 2.93 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.298 -178.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.647 ' HA ' ' HA ' ' B' ' 18' ' ' LYS . 32.1 t70 -60.35 -42.57 96.03 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.602 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.629 ' HB2' ' HZ3' ' B' ' 62' ' ' LYS . 0.5 OUTLIER 165.25 -84.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.161 0.984 . . . . 0.0 108.582 179.016 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.434 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 5.3 pt-20 -125.99 109.53 12.55 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 176.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.469 ' HB3' ' HE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.5 87.19 2.24 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.17 -176.799 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.554 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -138.75 -50.31 0.54 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.287 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.33 13.63 0.42 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.546 0.688 . . . . 0.0 110.264 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.874 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.62 127.51 31.74 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.144 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . 0.417 ' O ' ' HA ' ' B' ' 54' ' ' LYS . 2.9 m-80 -99.65 131.51 45.6 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.896 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.906 ' HB2' ' HG2' ' B' ' 54' ' ' LYS . 8.7 tt0 -136.33 132.93 36.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.683 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 405' ' ' GLU . 2.4 t30 175.58 45.63 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 123.986 0.804 . . . . 0.0 109.504 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -77.76 -35.37 51.8 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.35 -170.02 0.21 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.714 -179.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.582 ' HA ' ' NZ ' ' B' ' 51' ' ' LYS . 40.9 t0 -175.07 57.98 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.213 176.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 4.9 t70 . . . . . 0 C--O 1.255 1.354 0 CA-C-N 114.264 -1.335 . . . . 0.0 109.118 -179.85 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.472 ' HG2' ' HB1' ' B' ' 28' ' ' ALA . 3.0 ptm . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 120.296 0.093 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.86 -50.6 9.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.985 0.421 . . . . 0.0 110.644 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 6.0 m -130.27 -30.71 1.92 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.255 0.55 . . . . 0.0 110.349 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 53.4 m -151.26 -153.36 0.48 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.062 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 5.2 m -116.66 169.74 9.12 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 66.13 25.25 10.79 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.654 0.596 . . . . 0.0 110.581 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.561 ' O ' ' HA ' ' B' ' 27' ' ' MET . 91.2 mt-10 -74.09 101.41 3.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.478 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.6 t -82.75 106.54 13.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.402 ' HB2' HD22 ' B' ' 95' ' ' LEU . 19.5 mt -88.28 -28.85 20.82 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.486 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.403 ' CD2' HG21 ' B' ' 92' ' ' VAL . 5.9 tp -135.61 136.85 41.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.9 mt -121.66 120.14 60.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.778 HG22 HD21 ' B' ' 24' ' ' LEU . 3.5 t -110.89 150.02 13.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.463 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.542 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.1 mtmp? -116.4 175.89 5.35 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.406 -178.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.468 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.3 OUTLIER 17.87 70.9 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.679 0 O-C-N 125.346 1.654 . . . . 0.0 113.293 -178.527 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 13' ' ' LYS . 11.7 t -114.92 121.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.073 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.565 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 73.4 mtp85 -92.49 120.92 33.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.436 HE21 ' HB3' ' B' ' 17' ' ' GLN . 0.6 OUTLIER -113.27 103.37 11.25 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 178.311 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.647 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 57.5 mttp 63.76 56.44 1.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.076 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.546 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 0.3 OUTLIER 68.51 21.23 8.19 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.765 177.983 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.565 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tt0 -133.7 122.6 23.61 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.831 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.03 153.44 43.2 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.92 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.665 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 177.98 -170.75 43.13 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 116.148 -0.478 . . . . 0.0 112.706 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 131.74 54.04 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.944 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.31 139.1 33.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.542 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . 0.458 ' CD2' ' HE1' ' B' ' 41' ' ' PHE . 71.3 m-85 -132.7 122.75 25.08 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.866 HD12 HG12 ' B' ' 92' ' ' VAL . 14.0 mt -102.11 116.43 32.66 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.458 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.561 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 1.8 mpt? -93.99 162.45 13.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.472 ' HB1' ' HG2' ' B' ' 1' ' ' MET . . . -62.44 -8.76 6.66 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.467 ' HG3' ' HB3' ' B' ' 1' ' ' MET . 5.3 mp0 -127.9 -16.13 4.7 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -158.24 160.5 37.19 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.439 -176.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.965 HD12 HD11 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.37 118.66 53.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.968 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.522 ' HB2' ' HE1' ' B' ' 27' ' ' MET . . . -119.14 154.17 33.69 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.415 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.944 ' HB2' HD11 ' B' ' 24' ' ' LEU . 55.2 t90 -146.87 129.42 15.96 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.41 ' HB1' ' CD1' ' B' ' 41' ' ' PHE . . . -109.96 121.82 40.77 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.312 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.03 139.46 42.82 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.469 2.112 . . . . 0.0 111.833 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.665 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.0 mt-10 -57.92 132.04 52.22 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.628 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.09 -7.48 64.53 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.141 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -113.37 152.94 29.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.583 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -97.55 -7.32 31.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.36 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -124.24 152.02 43.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.109 0.48 . . . . 0.0 111.938 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.458 ' HE1' ' CD2' ' B' ' 25' ' ' TYR . 44.8 m-85 -81.16 121.81 26.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.901 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 12.7 p -91.46 -9.85 43.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 110.111 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.776 HG22 ' HZ ' ' B' ' 77' ' ' PHE . 19.0 mm -117.34 119.99 63.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.159 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 27.7 t -148.04 101.43 3.29 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.47 ' CD2' HG23 ' B' ' 43' ' ' ILE . 66.0 m-70 -125.99 132.95 51.93 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.485 ' O ' HG12 ' B' ' 50' ' ' ILE . 50.9 mtp -86.6 143.38 27.68 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.687 ' HB3' HD21 ' B' ' 100' ' ' LEU . 19.9 m-85 -59.92 -22.09 61.97 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.195 0.521 . . . . 0.0 109.959 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.86 -3.31 31.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.707 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.561 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 12.4 m-20 -118.78 -9.99 10.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.252 0.549 . . . . 0.0 110.105 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.801 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.3 mm -92.39 127.7 44.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.582 ' NZ ' ' HA ' ' A' ' 409' ' ' ASP . 29.1 tttp -87.15 -49.49 7.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.477 0.656 . . . . 0.0 110.069 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.08 -177.43 5.91 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.188 -178.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . 0.421 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 24.3 pt20 -144.49 146.78 32.6 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.969 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.093 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 39.3 mttp -109.06 146.18 34.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 177.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.512 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -125.11 128.54 73.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 176.211 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -90.87 118.66 68.77 Favored Pre-proline 0 C--O 1.25 1.105 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -178.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.55 173.03 13.14 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 125.196 3.931 . . . . 0.0 114.017 -177.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -61.35 160.24 11.12 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.79 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.84 -28.97 8.09 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -177.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.434 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 3.6 mttm -87.41 164.78 16.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.44 -14.96 57.86 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.314 0.578 . . . . 0.0 109.924 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.629 ' HZ3' ' HB2' ' A' ' 398' ' ' GLU . 0.0 OUTLIER -133.46 129.79 37.72 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.445 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.438 HG22 ' HA ' ' B' ' 86' ' ' VAL . 2.7 mp -77.98 129.6 37.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 177.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -135.67 163.63 29.71 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.686 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.8 tp -138.84 153.43 48.34 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 113.069 -1.878 . . . . 0.0 106.906 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.093 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.32 140.98 26.83 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 119.07 0.85 . . . . 0.0 110.33 178.336 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.965 HD11 HD12 ' B' ' 31' ' ' ILE . 94.3 mt -94.02 111.22 22.91 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.444 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.573 ' HA ' HG21 ' B' ' 74' ' ' THR . 15.0 t -95.73 102.83 14.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.727 HD23 HD12 ' B' ' 50' ' ' ILE . 1.3 mt -84.06 152.89 24.11 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.942 -176.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.561 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 1.6 p-80 -81.38 6.4 14.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.695 0.759 . . . . 0.0 109.004 178.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.82 -22.04 46.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.226 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.93 4.51 24.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.184 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . 0.511 ' OD2' HD13 ' B' ' 69' ' ' LEU . 4.5 p-10 -126.65 175.95 7.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.075 0.464 . . . . 0.0 111.807 -179.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.573 HG21 ' HA ' ' B' ' 68' ' ' VAL . 14.2 p -136.85 146.83 46.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -179.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.541 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 18.6 m -122.24 103.47 8.79 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.108 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.507 ' HB2' ' HB2' ' A' ' 397' ' ' ASP . 6.8 m-20 -81.98 150.86 27.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.265 0.555 . . . . 0.0 112.273 -178.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.776 ' HZ ' HG22 ' B' ' 43' ' ' ILE . 44.5 m-85 -137.34 117.85 13.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.31 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.628 ' CG ' ' HZ1' ' B' ' 62' ' ' LYS . 4.5 t-160 -92.15 113.69 26.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.708 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.686 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 65.2 m-85 -83.7 93.16 7.86 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.71 3.48 53.84 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.468 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.9 t-20 -85.1 91.19 8.05 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.09 -41.9 2.76 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.427 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.35 -59.84 3.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 20.8 p -127.78 7.93 6.25 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -176.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.578 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -41.1 -52.89 3.17 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.438 ' HA ' HG22 ' B' ' 63' ' ' ILE . 2.2 t -57.67 -49.11 81.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.471 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 5.8 mptt -70.06 -31.95 69.82 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.626 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.2 mt-10 -65.92 -44.1 86.15 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.488 ' HD2' HD12 ' B' ' 55' ' ' ILE . 23.4 ttp180 -56.51 -47.56 79.05 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . 0.621 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -63.39 -44.69 93.98 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.38 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.13 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.884 0.311 . . . . 0.0 111.424 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.866 HG12 HD12 ' B' ' 26' ' ' LEU . 57.0 t -59.81 -45.11 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.621 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.6 tmmt? -58.55 -54.56 45.72 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.007 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.07 -54.43 30.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.101 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.84 ' HG ' HD13 ' B' ' 99' ' ' LEU . 14.8 tp -65.29 -30.6 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.025 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.483 HD12 HG13 ' B' ' 92' ' ' VAL . 24.0 mt -76.18 -42.58 45.91 Favored 'General case' 0 C--O 1.216 -0.676 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -60.81 -24.52 65.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.379 1.085 . . . . 0.0 108.745 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.98 -46.62 11.86 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.551 -1.659 . . . . 0.0 111.363 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.84 HD13 ' HG ' ' B' ' 95' ' ' LEU . 11.5 mt -86.78 -28.11 23.18 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -176.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.801 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.3 mt -67.57 -58.64 8.15 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.0 -21.67 72.81 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.888 1.725 . . . . 0.0 112.993 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' B' ' 99' ' ' LEU . 3.8 ptmm? -87.91 2.2 52.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.598 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.477 ' HD2' ' O ' ' B' ' 99' ' ' LEU . 11.2 m-85 -127.66 -34.76 2.18 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -31.36 114.49 0.13 Allowed 'General case' 0 N--CA 1.477 0.889 0 O-C-N 124.031 0.832 . . . . 0.0 112.924 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 23.0 ttm105 -70.54 -30.57 67.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.892 -1.049 . . . . 0.0 112.457 -177.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.3 158.64 43.9 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.734 -0.387 . . . . 0.0 111.019 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -91.11 150.27 21.46 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.962 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 1.02 0 O-C-N 124.088 0.868 . . . . 0.0 111.27 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.9 p90 . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 27.7 t -67.3 127.59 29.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 94.54 -79.48 0.92 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.49 ' CD ' ' HZ3' ' B' ' 18' ' ' LYS . 1.2 tm-20 -92.06 123.37 35.37 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.529 ' C ' ' H ' ' A' ' 398' ' ' GLU . 6.2 p-10 -89.23 -1.39 58.06 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.586 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 3.5 t70 -70.25 15.83 0.08 Allowed 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.22 0.464 . . . . 0.0 111.938 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.586 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 0.8 OUTLIER 98.85 -93.1 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.343 1.457 . . . . 0.0 112.147 178.523 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.747 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 20.9 tt0 -123.7 117.88 25.97 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 122.058 0.143 . . . . 0.0 111.259 -178.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.564 ' HB3' ' HE2' ' A' ' 403' ' ' PHE . 5.1 m-20 -150.35 82.58 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.579 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.6 p-10 -139.01 -42.31 0.47 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.18 15.83 0.15 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.72 0.771 . . . . 0.0 110.93 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 1.054 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -55.86 132.31 49.21 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.693 179.307 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -115.45 127.79 55.58 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.369 -178.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.836 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 4.2 pt-20 -136.61 147.82 47.15 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -135.76 59.53 1.71 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.481 0.658 . . . . 0.0 111.219 -179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . 0.471 ' CB ' ' HB3' ' B' ' 52' ' ' CYS . 8.8 t70 -112.95 -24.86 9.27 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.921 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.23 -99.62 0.09 Allowed 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.231 -179.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.513 ' OD1' ' HE3' ' B' ' 106' ' ' LYS . 35.9 t70 -145.99 77.65 1.5 Allowed 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.734 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' B' ' 106' ' ' LYS . 31.3 t70 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.169 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 67.08 29.83 7.71 Favored 'General case' 0 C--O 1.232 0.176 0 O-C-N 123.891 0.745 . . . . 0.0 110.149 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.7 m -78.97 81.26 5.26 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.675 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 6.6 m 69.46 -93.74 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.36 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 35.8 m -159.95 167.1 28.78 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 67.1 26.57 8.84 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.965 0.791 . . . . 0.0 111.389 178.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.423 ' O ' ' HA ' ' B' ' 27' ' ' MET . 27.1 tt0 -104.1 116.92 33.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.044 0.449 . . . . 0.0 110.864 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.519 HG21 ' HE3' ' B' ' 27' ' ' MET . 90.9 t -82.78 120.73 34.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.126 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.407 ' HB2' HD21 ' B' ' 95' ' ' LEU . 45.3 mt -94.73 -30.36 14.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.618 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.0 tp -136.64 135.11 38.01 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 77.8 mt -118.55 119.55 61.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.695 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 2.8 t -108.46 148.64 12.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.812 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.564 ' O ' HG21 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.11 173.59 6.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.114 -178.627 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 17.75 68.24 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 O-C-N 125.163 1.539 . . . . 0.0 114.214 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.564 HG21 ' O ' ' B' ' 13' ' ' LYS . 24.4 t -117.08 126.85 74.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.628 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 12.0 mtt180 -99.18 133.64 43.18 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.36 0.6 . . . . 0.0 111.65 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.53 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 4.8 tp-100 -111.21 107.47 16.8 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.49 ' HZ3' ' CD ' ' A' ' 395' ' ' GLU . 0.0 OUTLIER 66.53 46.53 1.84 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.733 0.778 . . . . 0.0 109.264 -179.12 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.435 ' HZ2' ' HG2' ' B' ' 19' ' ' LYS . 0.3 OUTLIER 67.35 23.64 9.18 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.896 179.275 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.616 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.2 tt0 -122.16 119.19 30.57 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.381 -0.199 . . . . 0.0 110.776 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.481 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 1.2 m-20 -58.85 146.66 36.56 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.709 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 178.67 -169.39 40.89 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.082 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.28 137.2 53.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.949 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.48 137.79 35.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.917 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . 0.417 ' CD1' ' HE2' ' B' ' 41' ' ' PHE . 68.6 m-85 -131.96 117.4 18.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.741 HD13 HG11 ' B' ' 92' ' ' VAL . 12.3 mt -100.42 119.12 37.98 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.501 -178.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.519 ' HE3' HG21 ' B' ' 8' ' ' VAL . 2.3 mpt? -95.44 161.85 13.9 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -20.43 63.14 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.54 -22.2 11.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -178.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.487 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 1.6 ptp180 -155.28 160.86 41.11 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.713 -0.795 . . . . 0.0 112.592 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.794 HD13 HD13 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -104.0 122.15 56.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 114.81 -1.086 . . . . 0.0 108.282 179.028 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.4 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -125.84 155.37 41.27 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.182 0.515 . . . . 0.0 111.29 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.949 ' HB2' HD12 ' B' ' 24' ' ' LEU . 50.4 t90 -147.23 134.69 20.83 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.904 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -117.67 133.77 23.27 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.033 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.977 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 2.3 Cg_endo -77.14 146.38 25.35 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.377 2.051 . . . . 0.0 111.923 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.709 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 34.3 mt-10 -64.01 129.46 40.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.297 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.45 -0.02 61.35 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.439 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.977 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.9 mptt -113.42 154.37 27.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.322 . . . . 0.0 110.768 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -100.94 4.72 42.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.451 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -140.03 157.17 46.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.209 0.528 . . . . 0.0 111.895 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.417 ' HE2' ' CD1' ' B' ' 25' ' ' TYR . 61.2 m-85 -85.21 126.05 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.756 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.7 p -93.07 -19.07 21.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.263 0.554 . . . . 0.0 110.381 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.699 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 37.1 mm -110.71 118.63 57.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.23 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 43.6 t -147.8 101.33 3.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -126.36 138.82 53.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.785 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.509 ' O ' HG12 ' B' ' 50' ' ' ILE . 18.9 mmt -84.33 144.23 28.98 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.678 ' HB3' HD22 ' B' ' 100' ' ' LEU . 21.8 m-85 -61.45 -20.6 63.3 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.962 0.41 . . . . 0.0 110.564 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.59 -11.36 60.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.436 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.574 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.05 -11.56 15.28 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.204 0.526 . . . . 0.0 109.655 179.277 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.631 ' HB ' HD23 ' B' ' 100' ' ' LEU . 1.2 mm -91.38 131.0 39.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.404 ' O ' ' HE2' ' B' ' 104' ' ' LYS . 34.7 tttm -87.83 -43.38 11.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.359 0.6 . . . . 0.0 109.745 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.495 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.9 p -164.94 -177.59 4.75 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.261 -0.882 . . . . 0.0 109.602 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.67 142.2 41.13 Favored 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.126 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.054 ' HD3' ' HB3' ' A' ' 403' ' ' PHE . 50.2 mttp -105.28 150.89 24.76 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.535 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -126.95 129.39 71.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' SER . . . . . 0.463 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -93.41 121.49 64.97 Favored Pre-proline 0 C--O 1.252 1.21 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -68.15 172.89 10.29 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 125.071 3.847 . . . . 0.0 114.53 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -63.44 160.43 16.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.39 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.75 -29.19 7.97 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.747 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 22.7 mttp -88.47 155.2 19.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.47 -17.69 63.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.974 0.416 . . . . 0.0 110.991 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.593 ' HD3' ' CE1' ' B' ' 78' ' ' HIS . 17.3 pttt -132.47 134.21 44.78 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.731 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.615 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -78.84 134.9 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.615 ' OE1' ' HD3' ' B' ' 60' ' ' LYS . 0.2 OUTLIER -134.0 163.04 30.43 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 118.085 -1.446 . . . . 0.0 114.811 -176.165 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.423 ' HA ' ' O ' ' B' ' 54' ' ' LYS . 2.2 tp -141.95 153.51 44.38 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 113.111 -1.859 . . . . 0.0 107.24 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.006 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.53 141.71 28.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 118.93 0.787 . . . . 0.0 110.52 178.567 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.794 HD13 HD13 ' B' ' 31' ' ' ILE . 96.1 mt -93.83 100.28 12.49 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.884 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.607 ' HA ' HG22 ' B' ' 74' ' ' THR . 11.4 t -86.15 111.88 21.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.463 HD22 HD13 ' B' ' 50' ' ' ILE . 6.4 mt -94.26 156.6 16.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.998 0.428 . . . . 0.0 111.543 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.574 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -80.16 -1.4 40.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.248 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.28 -3.96 56.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.542 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.11 19.41 53.23 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.54 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . 0.463 ' HB3' HD12 ' B' ' 69' ' ' LEU . 21.7 t70 -125.96 158.9 34.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.254 . . . . 0.0 110.533 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.607 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.5 p -137.87 131.05 30.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.234 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.544 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.6 m -107.39 103.42 12.76 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.69 143.85 30.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.072 0.463 . . . . 0.0 112.162 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.699 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 41.6 m-85 -126.64 127.26 44.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.222 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.628 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.5 t-160 -92.37 101.3 13.77 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.178 -178.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.709 ' HZ ' HG23 ' B' ' 92' ' ' VAL . 24.8 m-85 -79.37 99.52 7.19 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.79 9.9 24.69 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.8 91.43 7.05 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.636 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.83 -41.94 1.69 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.451 -178.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -59.75 4.78 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.424 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.7 p -127.79 7.34 6.18 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 115.747 1.758 . . . . 0.0 115.747 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.703 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.73 -47.33 7.87 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.401 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.76 -51.44 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 111.084 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.5 mptt -69.06 -34.26 74.88 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.053 0.454 . . . . 0.0 109.858 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.673 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.9 mt-10 -64.83 -44.42 89.9 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.615 ' HD3' HG23 ' B' ' 63' ' ' ILE . 24.0 ttp180 -54.91 -47.18 74.7 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 122.052 0.929 . . . . 0.0 108.509 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . 0.565 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.51 -45.37 93.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.27 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.54 79.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.689 0.222 . . . . 0.0 111.411 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.741 HG11 HD13 ' B' ' 26' ' ' LEU . 46.8 t -61.69 -41.54 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.565 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.0 OUTLIER -59.87 -58.47 8.42 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.545 177.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.7 -51.42 63.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.937 -1.028 . . . . 0.0 112.31 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.733 ' HG ' HD11 ' B' ' 99' ' ' LEU . 15.5 tp -62.04 -42.61 99.36 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.844 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.433 HD11 HG12 ' B' ' 92' ' ' VAL . 20.7 mt -68.89 -41.03 78.84 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -64.2 -23.45 67.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 122.094 0.95 . . . . 0.0 109.116 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -84.08 -50.82 7.6 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.237 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.733 HD11 ' HG ' ' B' ' 95' ' ' LEU . 14.3 mt -75.25 -49.86 17.95 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 113.47 -1.696 . . . . 0.0 115.103 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.678 HD22 ' HB3' ' B' ' 47' ' ' TYR . 54.6 mt -50.36 -58.41 9.89 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.594 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.9 Cg_exo -54.96 -20.71 23.96 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.19 1.927 . . . . 0.0 113.448 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -88.0 -6.79 57.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.764 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -120.97 -35.63 3.29 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.64 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 0.0 OUTLIER -96.77 145.56 25.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.956 0.407 . . . . 0.0 110.971 -179.629 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -162.43 127.34 3.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.117 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.513 ' HE3' ' OD1' ' A' ' 409' ' ' ASP . 15.5 mtmm -91.34 -156.95 0.47 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.0 19.52 2.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.455 0.645 . . . . 0.0 109.719 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.401 ' H ' ' C ' ' B' ' 106' ' ' LYS . 3.0 t30 . . . . . 0 C--O 1.251 1.145 0 CA-C-N 114.491 -1.231 . . . . 0.0 108.502 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.511 ' HB2' ' HA ' ' A' ' 398' ' ' GLU . 82.4 t80 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 111.288 0.107 . . . . 0.0 111.288 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . 0.488 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 86.7 t 80.16 123.68 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -178.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 83.91 -86.65 1.52 Allowed Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.448 ' HA ' ' OE1' ' A' ' 395' ' ' GLU . 4.2 tp10 -99.78 83.84 2.81 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.464 ' O ' ' HE2' ' B' ' 19' ' ' LYS . 0.1 OUTLIER -70.96 30.99 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 -176.159 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.7 ' HB3' ' OD1' ' A' ' 400' ' ' ASP . 8.8 t70 -72.58 -8.95 57.8 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 175.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.617 ' OE2' ' HA ' ' A' ' 398' ' ' GLU . 0.4 OUTLIER 100.18 -14.97 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.496 1.918 . . . . 0.0 114.93 175.609 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.837 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 51.0 tt0 -178.71 92.91 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 118.508 0.595 . . . . 0.0 109.991 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.7 ' OD1' ' HB3' ' A' ' 397' ' ' ASP . 3.5 m-20 -144.95 89.63 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.521 -177.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.544 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.0 -48.11 0.49 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -74.39 20.57 0.11 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.694 0.759 . . . . 0.0 111.18 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.65 ' HE2' ' HB3' ' A' ' 400' ' ' ASP . 0.4 OUTLIER -54.37 132.09 43.43 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.328 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -88.8 121.0 30.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.963 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.441 ' HB3' ' CD ' ' A' ' 408' ' ' GLU . 0.8 OUTLIER -91.25 157.48 17.13 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.024 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -165.41 -40.63 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . 0.538 ' HB2' ' OE1' ' B' ' 97' ' ' GLN . 18.6 t70 -91.08 -11.87 37.35 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -177.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.441 ' CD ' ' HB3' ' A' ' 405' ' ' GLU . 1.2 pm0 -58.99 117.04 4.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.1 0.476 . . . . 0.0 111.182 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.1 -95.02 0.09 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.591 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.428 ' C ' ' HZ3' ' B' ' 51' ' ' LYS . 21.2 t70 . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.265 -0.874 . . . . 0.0 109.327 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.182 0 CA-C-O 120.47 0.176 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.24 -43.41 3.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.325 0.584 . . . . 0.0 109.554 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.26 -169.34 1.44 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.636 178.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 9.3 m -56.88 111.16 0.95 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.763 0.316 . . . . 0.0 110.619 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 1.9 p -169.88 36.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.716 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.476 ' HB3' ' NH2' ' B' ' 30' ' ' ARG . 0.1 OUTLIER -176.64 31.2 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.347 0.594 . . . . 0.0 109.646 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' B' ' 27' ' ' MET . 8.9 mp0 -60.93 122.4 14.81 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.388 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.443 HG22 ' HE1' ' B' ' 27' ' ' MET . 63.7 t -82.18 108.94 15.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.746 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 31.8 mt -81.3 -33.8 32.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.623 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.403 ' CD2' HG23 ' B' ' 92' ' ' VAL . 6.2 tp -132.11 128.63 38.55 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.423 HG12 HG11 ' B' ' 8' ' ' VAL . 66.3 mt -111.64 122.0 65.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.825 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.6 t -113.57 149.89 15.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.598 ' O ' HG22 ' B' ' 15' ' ' VAL . 1.5 mtmp? -116.71 179.32 4.04 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.666 -178.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 18.21 66.87 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 O-C-N 125.356 1.66 . . . . 0.0 113.491 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.598 HG22 ' O ' ' B' ' 13' ' ' LYS . 14.9 t -115.05 123.67 70.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.482 179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.631 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 54.3 mtt85 -97.44 122.34 40.37 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.233 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.693 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 0.7 OUTLIER -104.84 102.31 11.86 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 178.868 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.671 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 40.7 mttt 51.53 61.52 3.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.735 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.464 ' HE2' ' O ' ' A' ' 396' ' ' ASP . 0.0 OUTLIER 78.77 12.82 1.39 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 177.457 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.742 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 7.0 pt20 -130.52 125.88 35.41 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.393 0.997 . . . . 0.0 111.007 178.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -80.33 152.74 28.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -177.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 175.68 -159.17 26.76 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.948 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.23 137.53 52.91 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.907 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.21 140.25 35.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.729 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . 0.436 ' CD2' ' HE2' ' B' ' 41' ' ' PHE . 55.4 m-85 -134.83 122.9 22.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.81 HD11 HG12 ' B' ' 92' ' ' VAL . 15.8 mt -103.18 118.01 35.83 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.564 -0.455 . . . . 0.0 111.797 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.733 ' HE3' ' HB1' ' B' ' 32' ' ' ALA . 1.8 mpt? -93.36 163.01 13.76 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.08 -21.98 60.07 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -115.25 -15.46 11.61 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.518 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -158.83 166.6 31.52 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 119.744 -0.782 . . . . 0.0 112.892 -177.007 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.834 HD12 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -110.23 122.46 64.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.912 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.733 ' HB1' ' HE3' ' B' ' 27' ' ' MET . . . -124.14 152.81 42.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.085 0.469 . . . . 0.0 110.656 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.907 ' HB2' HD11 ' B' ' 24' ' ' LEU . 25.2 t90 -146.96 140.08 25.32 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.416 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -128.82 140.0 37.27 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.522 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.841 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 22.0 Cg_exo -64.02 158.48 47.39 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.625 2.217 . . . . 0.0 111.752 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.23 122.03 11.51 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.383 0.611 . . . . 0.0 111.967 -178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.36 29.73 59.64 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.308 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.841 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.48 146.72 39.14 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.046 0.423 . . . . 0.0 110.295 178.837 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -92.91 -20.75 20.33 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.938 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -113.18 144.43 42.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.48 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.436 ' HE2' ' CD2' ' B' ' 25' ' ' TYR . 84.5 m-85 -85.74 122.43 29.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.727 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.82 -17.5 33.27 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.351 0.596 . . . . 0.0 110.278 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.703 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -112.64 119.86 61.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.153 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.0 t -148.0 101.45 3.29 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.484 ' CD2' HG22 ' B' ' 43' ' ' ILE . 61.6 m-70 -126.59 131.09 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.669 0.271 . . . . 0.0 110.282 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.518 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 67.8 mmm -83.36 143.12 30.54 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.648 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.87 -24.21 56.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.025 0.441 . . . . 0.0 110.571 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.16 -9.03 58.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.922 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.627 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 34.7 m-20 -109.92 -8.83 14.81 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.214 0.53 . . . . 0.0 110.039 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.527 ' HB ' HD21 ' B' ' 100' ' ' LEU . 1.0 OUTLIER -88.28 129.47 39.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.049 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.428 ' HZ3' ' C ' ' A' ' 410' ' ' ASP . 31.0 tttp -86.01 -38.72 17.6 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.647 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.3 p -167.24 178.81 5.39 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.513 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -142.41 135.82 28.91 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.416 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.985 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 34.0 mttm -105.79 155.5 19.23 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.001 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.523 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.7 OUTLIER -128.12 129.99 69.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 176.453 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.42 122.37 63.05 Favored Pre-proline 0 C--O 1.25 1.107 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.661 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.21 172.89 11.3 Favored 'Trans proline' 0 C--O 1.235 0.342 1 C-N-CA 125.48 4.12 . . . . 0.0 114.657 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -65.14 160.41 21.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.824 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.42 -28.99 8.21 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.837 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 7.5 mttp -85.76 162.38 18.74 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.98 -17.73 60.49 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.114 0.483 . . . . 0.0 110.331 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.634 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 13.8 pttp -135.16 133.89 39.61 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.149 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.566 HG22 ' HD3' ' B' ' 89' ' ' ARG . 2.1 mp -79.58 129.91 36.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.528 ' OE1' ' HD3' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -133.13 163.68 28.73 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -175.11 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.505 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -139.37 153.02 47.59 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 112.963 -1.926 . . . . 0.0 106.432 176.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 0.985 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.1 135.33 22.82 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 119.405 1.002 . . . . 0.0 111.545 179.408 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.834 HD11 HD12 ' B' ' 31' ' ' ILE . 76.7 mt -93.72 99.18 11.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.477 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.647 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.2 t -85.11 105.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.46 HD22 HD12 ' B' ' 50' ' ' ILE . 4.3 mt -89.88 155.7 18.97 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.146 0.498 . . . . 0.0 112.08 -177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.627 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -81.4 4.32 21.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.718 0.771 . . . . 0.0 109.002 177.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -86.27 -5.84 59.1 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.206 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.46 13.96 56.33 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.095 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -126.27 155.14 42.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.761 0.315 . . . . 0.0 110.848 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.516 HG22 ' HA ' ' B' ' 68' ' ' VAL . 10.0 p -127.37 131.23 50.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.521 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.554 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.84 98.75 8.38 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.787 0.327 . . . . 0.0 110.16 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.449 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 2.7 m-20 -86.29 147.95 25.84 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.096 0.474 . . . . 0.0 111.381 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.703 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 61.4 m-85 -131.9 116.57 17.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.691 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.525 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.9 t-160 -86.95 103.48 15.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.61 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.701 ' HB3' ' HB2' ' B' ' 85' ' ' ALA . 51.2 m-85 -76.5 96.91 4.19 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.96 19.53 20.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.411 HD21 ' HA ' ' B' ' 81' ' ' ASN . 1.0 OUTLIER -90.91 93.6 9.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.291 0.567 . . . . 0.0 109.589 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.76 -32.64 0.63 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.01 -59.47 2.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.539 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.5 p -127.39 10.86 6.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -176.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.701 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -43.39 -52.1 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.477 HG21 HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.75 -50.58 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.691 0.281 . . . . 0.0 111.221 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.539 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.7 mttt -67.53 -33.63 75.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.64 ' O ' HG22 ' B' ' 92' ' ' VAL . 12.1 mt-10 -64.63 -44.41 90.59 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.566 ' HD3' HG22 ' B' ' 63' ' ' ILE . 20.7 ttp180 -56.43 -47.1 79.79 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.68 -41.9 99.34 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.757 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.8 -41.47 78.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.614 0.188 . . . . 0.0 111.243 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.81 HG12 HD11 ' B' ' 26' ' ' LEU . 38.6 t -62.4 -43.53 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.06 -52.79 64.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.096 178.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -57.16 -53.49 57.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.605 -179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.814 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.3 tp -63.61 -36.98 85.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.008 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.8 mt -70.42 -45.1 66.56 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 110.43 -0.211 . . . . 0.0 110.43 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . 0.538 ' OE1' ' HB2' ' A' ' 407' ' ' ASP . 12.0 mm100 -62.43 -21.27 65.28 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.007 0.908 . . . . 0.0 109.461 178.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.34 -47.41 9.39 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.194 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.814 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.2 mt -81.44 -46.29 14.79 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -176.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.648 HD23 ' HB3' ' B' ' 47' ' ' TYR . 38.3 mt -52.38 -58.19 12.62 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.608 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 59.2 Cg_exo -54.68 -19.85 19.84 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.325 2.016 . . . . 0.0 113.829 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -84.88 -21.19 29.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 0.0 111.346 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -111.9 -17.76 12.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.659 0.266 . . . . 0.0 111.355 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -63.87 100.5 0.3 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.561 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . 0.454 ' HB3' ' OXT' ' B' ' 108' ' ' ASN . 6.3 mmp_? -128.86 -106.83 0.29 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.63 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp 70.73 -59.3 0.54 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.532 0.733 . . . . 0.0 112.338 178.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.13 20.94 17.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.214 0.53 . . . . 0.0 110.793 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.454 ' OXT' ' HB3' ' B' ' 105' ' ' ARG . 3.1 t-20 . . . . . 0 C--O 1.248 1.012 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.49 ' O ' ' HB ' ' A' ' 393' ' ' VAL . 2.2 p90 . . . . . 0 N--CA 1.482 1.144 0 CA-C-O 120.703 0.287 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . 0.49 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 87.2 t 78.14 121.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.028 0.531 . . . . 0.0 110.029 -179.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 85.32 -59.91 4.79 Favored Glycine 0 CA--C 1.509 -0.314 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -178.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.484 ' OE2' ' HG2' ' B' ' 18' ' ' LYS . 7.5 tp10 -116.57 102.77 9.76 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 176.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -123.83 31.48 5.85 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.461 -177.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.615 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 27.8 t70 -38.4 -36.34 0.23 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.533 ' HG3' ' NZ ' ' B' ' 19' ' ' LYS . 4.5 tt0 177.5 -82.18 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 177.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.905 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.5 tt0 -131.25 101.48 5.58 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -178.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.667 ' HB3' HD22 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -136.37 89.52 2.48 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 -176.199 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.492 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.0 p-10 -139.31 -46.6 0.46 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -72.92 9.37 1.18 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.24 0.543 . . . . 0.0 110.846 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.641 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -50.25 120.26 4.37 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.033 179.812 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.35 131.93 39.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.325 -178.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.473 ' HB3' ' CD ' ' A' ' 408' ' ' GLU . 3.4 mt-10 -97.87 172.6 7.56 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.788 -178.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -162.02 -77.5 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.055 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . 0.704 ' HB2' ' HB3' ' B' ' 52' ' ' CYS . 0.8 OUTLIER -68.25 -57.55 5.81 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.255 0.55 . . . . 0.0 109.832 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.608 ' O ' ' HE3' ' B' ' 51' ' ' LYS . 0.0 OUTLIER 58.91 -115.98 0.82 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.067 179.428 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.505 ' HA ' ' CE ' ' B' ' 51' ' ' LYS . 17.6 t0 -82.7 53.95 2.53 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.565 0.697 . . . . 0.0 110.464 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.247 0.922 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.138 179.091 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.5 mmt . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 120.532 0.206 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.2 -31.62 0.69 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.704 0.288 . . . . 0.0 111.661 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.37 175.61 5.44 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.929 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.66 -51.79 7.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.004 0.43 . . . . 0.0 110.693 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 9.9 m -96.87 97.25 9.13 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.096 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -124.55 -133.58 0.27 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.287 0.565 . . . . 0.0 110.592 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.428 ' OE1' ' HG ' ' B' ' 9' ' ' LEU . 0.0 OUTLIER -58.87 150.15 24.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.53 179.57 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 42.9 t -123.77 122.34 64.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 178.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.428 ' HG ' ' OE1' ' B' ' 7' ' ' GLU . 73.9 mt -91.09 -29.34 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.931 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.49 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -139.65 131.32 27.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 78.9 mt -115.05 122.68 69.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.843 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.7 t -114.33 150.34 16.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.637 ' O ' HG21 ' B' ' 15' ' ' VAL . 1.7 mtmp? -114.8 177.22 4.73 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.488 -178.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.561 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.71 73.33 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 O-C-N 125.152 1.533 . . . . 0.0 113.343 -178.395 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.725 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.6 t -126.12 129.36 72.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.396 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.684 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 0.3 OUTLIER -99.6 145.19 27.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.053 0.454 . . . . 0.0 111.332 179.666 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.647 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -132.48 103.22 6.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.169 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.484 ' HG2' ' OE2' ' A' ' 395' ' ' GLU . 35.2 mttp 58.82 54.39 5.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.929 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.615 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 5.0 mptp? 72.19 23.99 3.22 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.898 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.684 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 36.9 mt-30 -126.29 119.63 27.88 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.545 ' HA ' ' HG3' ' B' ' 16' ' ' ARG . 0.8 OUTLIER -85.36 139.18 31.77 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.86 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -174.37 -151.06 8.07 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.753 -0.736 . . . . 0.0 113.589 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.3 140.18 52.38 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 122.73 0.412 . . . . 0.0 110.008 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.919 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -102.03 145.7 28.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.471 -178.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -139.33 112.77 8.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.735 0.303 . . . . 0.0 110.357 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.952 HD11 HG13 ' B' ' 92' ' ' VAL . 12.1 mt -90.27 137.23 32.51 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.13 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.517 ' HB3' ' NH2' ' B' ' 30' ' ' ARG . 42.8 mtt -120.8 167.19 12.77 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.028 -178.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.14 -49.76 8.89 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -122.75 11.59 9.76 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.458 -178.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.562 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.0 OUTLIER -159.6 156.4 27.92 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.253 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 1.0 HD11 HD12 ' B' ' 67' ' ' LEU . 1.5 tt -111.59 122.01 65.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -120.17 150.84 40.0 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.983 0.42 . . . . 0.0 110.775 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.919 ' HB2' HD11 ' B' ' 24' ' ' LEU . 48.2 t90 -146.99 141.2 26.19 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.857 ' HB1' ' HD3' ' B' ' 38' ' ' LYS . . . -139.6 129.46 14.11 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.56 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.86 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 21.1 Cg_endo -62.87 167.42 12.1 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.873 2.382 . . . . 0.0 112.489 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.543 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 72.4 mt-10 -81.65 124.0 29.19 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.479 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 118.36 -30.29 6.07 Favored Glycine 0 C--O 1.228 -0.281 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.766 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.857 ' HD3' ' HB1' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -75.14 171.73 13.64 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.499 0.666 . . . . 0.0 111.762 -179.943 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . 0.508 ' OD1' ' HG3' ' B' ' 40' ' ' ARG . 18.1 p-10 -115.74 -23.07 8.84 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.168 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.508 ' HG3' ' OD1' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -117.72 149.54 40.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.368 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.472 ' HA ' ' HB3' ' B' ' 34' ' ' ALA . 50.5 m-85 -70.32 154.61 41.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.576 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.8 p -115.48 -43.3 3.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.258 0.552 . . . . 0.0 109.801 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.647 HG13 ' HG3' ' B' ' 17' ' ' GLN . 18.6 mm -91.44 121.21 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.931 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 23.0 t -147.64 101.39 3.33 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.412 ' CD2' HG23 ' B' ' 43' ' ' ILE . 77.5 m-70 -125.94 138.78 53.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.919 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.562 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 78.8 mmm -88.85 143.75 26.68 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.543 ' CE1' HD11 ' B' ' 99' ' ' LEU . 21.9 m-30 -58.12 -20.73 42.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.304 0.573 . . . . 0.0 109.802 178.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . 0.507 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -72.81 -18.52 61.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.81 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.644 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.79 -6.36 21.53 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 123.46 0.475 . . . . 0.0 110.232 -179.731 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.562 HD13 HD21 ' B' ' 69' ' ' LEU . 1.6 mm -90.37 130.58 39.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.608 ' HE3' ' O ' ' A' ' 408' ' ' GLU . 31.8 tttp -91.06 -44.41 9.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.488 0.661 . . . . 0.0 110.427 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.704 ' HB3' ' HB2' ' A' ' 407' ' ' ASP . 1.2 p -158.25 -177.31 6.46 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.497 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . 0.446 HE22 ' HB2' ' B' ' 96' ' ' LEU . 5.0 pt20 -145.3 148.77 33.8 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.793 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.077 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 42.2 mttm -117.03 154.11 31.5 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 176.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.677 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -130.22 128.72 64.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.801 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.6 p -88.81 119.8 69.99 Favored Pre-proline 0 C--O 1.249 1.042 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.155 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.76 173.54 13.79 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 125.255 3.97 . . . . 0.0 114.275 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -59.45 160.93 6.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.127 178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.18 -29.25 7.79 Favored Glycine 0 C--N 1.317 -0.477 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -177.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.905 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.5 mttp -89.51 153.14 21.03 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.29 -3.36 16.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.249 0.547 . . . . 0.0 110.64 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.81 154.26 45.09 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.288 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.609 HG21 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -99.85 135.23 36.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -137.79 162.95 32.58 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.844 -1.142 . . . . 0.0 113.991 -177.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.623 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.4 tp -139.92 153.66 47.01 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.276 177.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.077 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -143.87 141.3 30.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.938 0.79 . . . . 0.0 111.278 178.742 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 1.0 HD12 HD11 ' B' ' 31' ' ' ILE . 64.7 mt -97.77 103.78 15.75 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.145 178.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.615 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.8 t -87.16 105.91 15.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.562 HD21 HD13 ' B' ' 50' ' ' ILE . 3.4 mt -91.18 158.1 16.81 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.012 -177.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.644 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.15 -1.68 45.47 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.162 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.76 -10.69 59.67 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.475 -1.238 . . . . 0.0 110.314 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.84 12.86 48.75 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.058 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -126.33 158.14 36.61 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.964 0.412 . . . . 0.0 110.929 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.599 HG23 ' HA ' ' B' ' 68' ' ' VAL . 15.9 p -128.59 131.6 48.17 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.6 m -104.37 105.34 15.44 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.359 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.667 HD22 ' HB3' ' A' ' 400' ' ' ASP . 5.0 m-20 -82.29 136.97 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.363 0.602 . . . . 0.0 111.956 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.415 ' HZ ' HG22 ' B' ' 43' ' ' ILE . 44.1 m-85 -121.63 110.85 16.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.598 178.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.725 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.8 t60 -86.53 99.1 11.44 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.658 -1.155 . . . . 0.0 111.804 -177.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.641 ' CE2' HG12 ' B' ' 12' ' ' VAL . 71.6 m-85 -77.26 94.24 4.11 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 178.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.18 1.54 39.17 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.561 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -79.99 91.38 5.44 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.86 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.82 -39.68 2.59 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.6 -59.62 4.36 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.505 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.4 p -127.81 9.0 6.35 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -176.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.485 ' HB3' ' HB3' ' B' ' 79' ' ' PHE . . . -43.23 -50.71 6.4 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.42 HG23 HG12 ' B' ' 63' ' ' ILE . 2.5 t -58.4 -51.91 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.82 0.343 . . . . 0.0 110.811 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.505 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.3 mttt -66.6 -35.17 79.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.874 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.642 ' O ' HG21 ' B' ' 92' ' ' VAL . 12.0 mt-10 -63.35 -46.54 86.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.609 ' HD3' HG21 ' B' ' 63' ' ' ILE . 22.2 ttp180 -55.73 -48.47 75.14 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . 0.515 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -61.56 -44.66 96.62 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.052 -1.431 . . . . 0.0 112.502 -179.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -43.19 76.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.89 0.314 . . . . 0.0 111.097 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.952 HG13 HD11 ' B' ' 26' ' ' LEU . 58.0 t -60.8 -43.57 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.677 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.2 tmmt? -60.37 -55.9 27.95 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.813 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -53.32 -55.39 25.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.891 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.753 ' HG ' HD12 ' B' ' 99' ' ' LEU . 14.0 tp -60.96 -41.25 95.99 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.96 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.483 HD13 HG11 ' B' ' 92' ' ' VAL . 27.1 mt -69.36 -42.79 74.77 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.392 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -66.0 -18.51 65.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.903 0.859 . . . . 0.0 109.368 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.02 -51.01 6.62 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.759 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.753 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -77.48 -48.15 17.83 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.451 -1.704 . . . . 0.0 115.019 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.542 HD23 ' HB3' ' B' ' 47' ' ' TYR . 19.0 mt -48.92 -56.29 16.07 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.581 ' HA ' ' HG2' ' B' ' 104' ' ' LYS . 19.6 Cg_endo -57.05 -15.33 17.21 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.27 1.98 . . . . 0.0 114.034 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.2 mttm -87.59 -20.51 26.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.507 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 26.7 m-85 -125.8 -19.54 4.86 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.581 ' HG2' ' HA ' ' B' ' 101' ' ' PRO . 16.4 ptpt -53.86 149.45 8.81 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.4 118.21 36.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.071 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.454 ' HD3' ' H ' ' B' ' 107' ' ' ALA . 0.0 OUTLIER -156.52 -46.4 0.07 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.311 178.761 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . 0.454 ' H ' ' HD3' ' B' ' 106' ' ' LYS . . . -154.62 34.51 0.41 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-N 114.528 -1.214 . . . . 0.0 108.49 -178.388 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.721 ' CE2' ' HB3' ' A' ' 395' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 7.7 p -77.61 128.4 38.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 91.31 -63.71 2.69 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.314 -179.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.721 ' HB3' ' CE2' ' A' ' 392' ' ' TYR . 4.7 tp10 -97.29 139.2 33.61 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.511 ' C ' ' H ' ' A' ' 398' ' ' GLU . 25.0 t70 -126.82 32.84 5.05 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.53 16.88 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.934 -1.104 . . . . 0.0 113.76 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.511 ' H ' ' C ' ' A' ' 396' ' ' ASP . 2.5 pt-20 89.2 -37.73 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.334 1.454 . . . . 0.0 113.616 176.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.5 ' HB2' ' HZ1' ' B' ' 62' ' ' LYS . 7.2 tt0 -150.05 122.61 8.54 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.834 ' HB3' HD22 ' B' ' 76' ' ' ASN . 0.6 OUTLIER -170.63 83.97 0.1 Allowed 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.929 -177.625 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.7 p-10 -138.52 -46.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . 0.481 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 2.6 p30 -72.8 7.25 2.06 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.498 0.666 . . . . 0.0 110.208 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.984 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -54.1 126.51 23.01 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.794 179.467 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -111.15 122.15 47.14 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.966 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 8.0 pt-20 -125.61 131.17 52.74 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -178.94 28.34 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.027 0.441 . . . . 0.0 110.662 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.85 -25.79 61.23 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.514 ' OE2' ' HE2' ' B' ' 104' ' ' LYS . 3.5 pt-20 -179.67 -172.09 0.2 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.852 178.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -151.09 89.9 1.56 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.504 ' OD2' ' HB3' ' B' ' 106' ' ' LYS . 17.7 t70 . . . . . 0 C--O 1.243 0.747 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.16 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.569 ' HA ' ' HG2' ' B' ' 6' ' ' GLU . 13.2 tpt . . . . . 0 N--CA 1.484 1.229 0 CA-C-O 120.624 0.249 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.17 -68.24 0.17 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.154 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 24.2 m -155.35 -46.65 0.08 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 3.2 p -160.85 -62.05 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.942 0.401 . . . . 0.0 110.099 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 2.5 m -84.05 81.01 8.98 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.569 ' HG2' ' HA ' ' B' ' 1' ' ' MET . 0.5 OUTLIER -84.61 -169.42 2.62 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.627 -177.207 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.417 ' O ' ' HA ' ' B' ' 27' ' ' MET . 3.0 mp0 -59.22 101.86 0.11 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.686 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 79.7 t -82.8 105.34 12.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.4 mt -84.44 -29.54 26.01 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.728 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.468 HD21 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.32 125.56 29.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.9 mt -112.68 116.07 51.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.743 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -107.05 147.77 11.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.567 ' O ' HG21 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -107.84 175.38 5.5 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.051 -178.54 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.665 ' HE2' ' HA ' ' B' ' 81' ' ' ASN . 29.3 mtpt 18.23 76.17 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 O-C-N 125.147 1.53 . . . . 0.0 113.552 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.567 HG21 ' O ' ' B' ' 13' ' ' LYS . 40.1 t -124.2 120.14 58.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.811 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.574 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 26.3 mtp180 -90.85 125.9 35.88 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.223 0.535 . . . . 0.0 111.032 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.421 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 2.8 tp-100 -117.21 112.18 20.47 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.882 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.1 OUTLIER 66.12 43.18 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.601 0.563 . . . . 0.0 110.639 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 70.59 19.28 6.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.472 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.488 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tt0 -125.93 119.22 27.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.452 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.427 ' CG ' ' HG2' ' B' ' 16' ' ' ARG . 2.2 m-20 -68.68 153.74 43.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.037 0.446 . . . . 0.0 111.689 -179.257 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 178.43 -158.88 23.83 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.038 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 134.59 49.99 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.218 0.532 . . . . 0.0 110.62 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.944 HD11 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.33 139.73 32.85 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.509 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -135.94 108.52 7.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.584 0.23 . . . . 0.0 110.417 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.936 HD12 HG12 ' B' ' 92' ' ' VAL . 9.3 mt -86.84 125.65 34.12 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.586 ' HB2' ' HD2' ' B' ' 30' ' ' ARG . 5.4 mtm -106.69 173.67 6.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.921 0.391 . . . . 0.0 111.57 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.42 -52.9 7.39 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -118.22 8.03 12.23 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.586 ' HD2' ' HB2' ' B' ' 27' ' ' MET . 0.0 OUTLIER -158.7 151.0 21.55 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.95 -1.1 . . . . 0.0 112.666 -178.249 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.911 HD13 HD11 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -97.69 122.77 49.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.576 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -124.78 156.64 37.4 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.993 0.425 . . . . 0.0 110.828 -179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.944 ' HB2' HD11 ' B' ' 24' ' ' LEU . 39.1 t90 -147.12 132.72 18.78 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.447 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -114.7 136.25 22.44 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.105 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.859 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 24.0 Cg_exo -61.57 159.06 33.75 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.19 1.927 . . . . 0.0 111.062 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -62.47 134.54 56.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.308 0.575 . . . . 0.0 111.682 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 62.62 12.35 40.24 Favored Glycine 0 CA--C 1.521 0.414 0 CA-C-N 115.552 -0.749 . . . . 0.0 113.993 179.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.859 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 40.4 mttp -113.43 140.77 47.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.384 0.592 . . . . 0.0 110.807 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -85.18 -14.12 47.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.141 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.437 ' H ' ' HG2' ' B' ' 40' ' ' ARG . 2.2 ptp180 -106.13 129.9 54.12 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.188 0.518 . . . . 0.0 112.322 -178.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.447 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 45.3 m-85 -78.19 121.14 23.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.26 178.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 7.5 p -94.62 -7.72 40.1 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.634 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -119.95 118.65 57.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.306 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.2 t -148.01 101.61 3.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.823 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -124.13 137.22 54.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.464 ' O ' HG12 ' B' ' 50' ' ' ILE . 33.0 mtp -88.94 142.32 27.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.605 ' HB3' ' HA ' ' B' ' 100' ' ' LEU . 20.4 m-85 -57.5 -23.0 47.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.696 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.26 -27.21 65.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.938 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.571 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.15 -5.84 43.14 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.873 0.368 . . . . 0.0 111.147 -179.025 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.776 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -89.36 129.86 39.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.607 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 1.1 tttp -90.06 -41.39 11.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.201 0.524 . . . . 0.0 110.641 -178.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.607 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 4.7 p -163.79 -177.6 5.23 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.76 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . 0.641 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 5.5 pt20 -140.58 145.49 36.8 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.371 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.078 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 53.6 mttp -108.39 136.7 47.59 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.498 HG22 ' HG3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -118.78 124.63 73.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 176.056 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -85.04 118.35 70.7 Favored Pre-proline 0 C--O 1.25 1.102 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -178.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.88 173.24 10.46 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 125.117 3.878 . . . . 0.0 113.996 -178.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 160.5 5.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.482 -1.235 . . . . 0.0 109.885 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.13 7.91 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.49 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 5.6 mttp -86.82 153.79 21.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.57 -14.14 62.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.436 0.636 . . . . 0.0 109.944 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.5 ' HZ1' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -137.69 141.79 41.08 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.557 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.501 HG12 ' CG2' ' B' ' 86' ' ' VAL . 3.8 mp -84.27 133.81 28.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -134.57 162.89 31.03 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 118.559 -1.256 . . . . 0.0 114.359 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.474 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.82 152.96 46.94 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 113.791 -1.55 . . . . 0.0 107.909 177.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.078 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.72 145.58 30.03 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.629 0.649 . . . . 0.0 110.48 177.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.911 HD11 HD13 ' B' ' 31' ' ' ILE . 96.1 mt -96.94 111.7 23.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.052 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.516 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 12.1 t -95.54 112.86 28.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.598 HD23 HD12 ' B' ' 50' ' ' ILE . 1.7 mt -97.43 158.46 15.46 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.571 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -80.21 -1.77 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.29 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . 0.416 ' HB2' ' OD1' ' B' ' 73' ' ' ASP . . . -73.46 -16.68 61.3 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.67 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 103.02 8.66 41.4 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.899 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . 0.494 ' OD1' HD12 ' B' ' 69' ' ' LEU . 8.0 p-10 -126.42 172.24 10.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.199 0.523 . . . . 0.0 111.841 -179.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 30.4 p -137.58 143.57 41.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.574 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.552 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 16.7 m -116.82 109.38 17.02 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.504 0.322 . . . . 0.0 110.511 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.834 HD22 ' HB3' ' A' ' 400' ' ' ASP . 4.9 m-20 -82.31 154.46 25.3 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.38 0.61 . . . . 0.0 112.628 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.634 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.7 m-85 -141.5 104.01 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.834 -1.075 . . . . 0.0 108.834 178.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.574 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.2 t-160 -86.9 105.28 16.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.493 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.648 ' CE1' HG11 ' B' ' 12' ' ' VAL . 48.9 m-85 -76.71 101.61 5.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.3 p -95.62 7.27 46.75 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.949 0.404 . . . . 0.0 111.69 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.665 ' HA ' ' HE2' ' B' ' 14' ' ' LYS . 63.8 t30 -86.09 90.81 8.23 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -33.66 18.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 41.1 m -58.89 -59.96 4.62 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.476 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.78 13.15 6.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.55 ' HB3' ' HB3' ' B' ' 79' ' ' PHE . . . -46.52 -45.01 18.27 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.501 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.9 t -59.57 -54.72 30.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.006 0.432 . . . . 0.0 110.563 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.476 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.7 mptt -65.56 -36.76 84.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.192 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.672 ' O ' HG21 ' B' ' 92' ' ' VAL . 14.0 mt-10 -65.04 -43.56 91.97 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.49 ' HD3' HG22 ' B' ' 63' ' ' ILE . 23.9 ttp180 -56.6 -49.26 75.45 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.51 -42.75 97.06 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.368 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -44.1 78.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.822 0.283 . . . . 0.0 110.97 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.936 HG12 HD12 ' B' ' 26' ' ' LEU . 38.9 t -60.26 -43.63 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.641 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 2.9 ttpt -60.19 -53.42 57.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.138 178.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 2.1 m-20 -56.3 -51.25 68.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.879 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.537 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.7 tp -64.89 -37.39 87.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.719 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.41 HD12 HG13 ' B' ' 92' ' ' VAL . 27.9 mt -72.31 -47.59 48.72 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 121.308 -0.157 . . . . 0.0 111.06 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' B' ' 94' ' ' ASP . 13.5 pt20 -60.01 -21.66 61.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.193 0.997 . . . . 0.0 109.143 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 1.4 mm-40 -85.94 -47.83 9.26 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.135 -1.393 . . . . 0.0 111.363 178.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.537 HD12 ' HG ' ' B' ' 95' ' ' LEU . 13.6 mt -81.84 -38.69 25.09 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.776 HD22 ' HB ' ' B' ' 50' ' ' ILE . 30.2 mt -53.14 -62.66 3.18 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.582 ' HA ' ' HE3' ' B' ' 104' ' ' LYS . 40.3 Cg_endo -66.51 -7.7 18.64 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.815 1.677 . . . . 0.0 113.36 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 12.4 mtmm -81.26 -31.87 33.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.784 0.326 . . . . 0.0 110.309 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -104.87 -35.4 7.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.196 0.522 . . . . 0.0 110.614 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.582 ' HE3' ' HA ' ' B' ' 101' ' ' PRO . 0.8 OUTLIER -77.34 110.72 12.31 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.002 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -124.81 60.71 1.18 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.166 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.504 ' HB3' ' OD2' ' A' ' 410' ' ' ASP . 2.4 ttpm? -95.73 -61.31 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.546 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -144.21 15.57 1.68 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.434 -0.506 . . . . 0.0 112.199 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.42 ' HB3' ' NZ ' ' B' ' 104' ' ' LYS . 55.6 t30 . . . . . 0 C--O 1.249 1.065 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.587 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.55 ' CG ' ' HB2' ' A' ' 396' ' ' ASP . 0.3 OUTLIER . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.523 0.202 . . . . 0.0 110.526 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.15 -107.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -73.84 -18.05 79.47 Favored Glycine 0 C--O 1.227 -0.311 0 N-CA-C 108.34 -1.904 . . . . 0.0 108.34 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.423 ' HG3' ' H ' ' A' ' 397' ' ' ASP . 7.2 tp10 -172.15 157.75 4.36 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 112.609 -1.795 . . . . 0.0 106.192 178.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.55 ' HB2' ' CG ' ' A' ' 392' ' ' TYR . 17.1 t70 -105.81 30.44 5.8 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.579 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.551 ' HB3' ' OD1' ' A' ' 400' ' ' ASP . 14.6 t70 -53.78 -34.93 60.62 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 0.1 OUTLIER 166.49 -30.04 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 O-C-N 124.332 1.02 . . . . 0.0 110.396 177.666 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.899 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 65.1 tt0 173.01 95.08 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -178.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.618 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 2.4 m-20 -140.87 92.05 2.47 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.451 -175.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.539 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.4 OUTLIER -139.51 -48.39 0.47 Allowed 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -73.13 17.5 0.13 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.636 0.731 . . . . 0.0 111.229 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.883 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -55.64 128.74 36.09 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.878 179.124 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -101.9 133.33 46.85 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.4 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.5 ' CD ' ' HG ' ' B' ' 52' ' ' CYS . 10.0 tt0 -121.8 139.98 52.93 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.214 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.23 42.44 0.13 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . 0.549 ' HB3' ' HB2' ' B' ' 52' ' ' CYS . 1.3 t70 -109.61 -7.28 15.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.882 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.425 ' HB3' ' H ' ' A' ' 409' ' ' ASP . 0.4 OUTLIER 52.98 -159.29 0.13 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.954 -1.021 . . . . 0.0 113.032 179.457 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.425 ' H ' ' HB3' ' A' ' 408' ' ' GLU . 1.3 m-20 -111.94 8.83 20.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.046 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.404 ' C ' ' HD2' ' B' ' 104' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.905 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.377 -179.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.541 ' H ' ' CD ' ' B' ' 6' ' ' GLU . 1.9 mpt? . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.71 37.17 19.19 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.501 0.667 . . . . 0.0 109.762 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 4.5 m -77.83 -63.28 1.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.609 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.575 ' HB2' ' HG2' ' B' ' 29' ' ' GLU . 20.0 m -148.41 -57.71 0.23 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 121.199 -0.2 . . . . 0.0 110.824 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 2.7 p -129.45 -28.52 2.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' B' ' 1' ' ' MET . 5.2 tp10 66.45 21.45 10.83 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.859 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.453 ' O ' ' HA ' ' B' ' 27' ' ' MET . 15.2 pt-20 -81.56 115.65 20.96 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.041 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 70.2 t -84.13 112.6 21.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.67 ' HB2' HD21 ' B' ' 95' ' ' LEU . 23.0 mt -87.04 -28.9 22.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.158 -178.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.418 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -140.1 138.24 35.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 86.1 mt -121.75 126.47 74.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.674 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.0 t -118.25 148.24 21.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.632 ' O ' HG21 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -110.62 -178.68 3.55 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.349 -179.358 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.486 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 47.8 mtpt 18.06 69.39 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 O-C-N 125.42 1.7 . . . . 0.0 113.559 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.632 HG21 ' O ' ' B' ' 13' ' ' LYS . 25.5 t -119.17 123.35 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.558 179.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.634 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 13.8 mtp-105 -98.14 121.36 39.97 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.086 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.425 HE21 ' HB3' ' B' ' 17' ' ' GLN . 0.7 OUTLIER -105.63 103.29 12.77 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.157 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.548 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 50.9 mttt 52.81 62.87 2.47 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.761 0.663 . . . . 0.0 110.937 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.548 ' HE3' ' O ' ' A' ' 396' ' ' ASP . 1.9 mptm? 68.43 24.61 7.13 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 113.088 178.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.634 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 20.5 mt-30 -129.84 119.31 23.13 Favored 'General case' 0 C--O 1.222 -0.375 0 O-C-N 122.23 -0.293 . . . . 0.0 111.275 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -75.08 145.04 42.64 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.149 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.33 -167.64 39.34 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.653 -0.784 . . . . 0.0 113.613 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.86 137.68 54.69 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.125 0.57 . . . . 0.0 109.803 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.916 HD13 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -100.54 140.82 34.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.232 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -135.62 124.67 24.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.81 HD12 HG11 ' B' ' 92' ' ' VAL . 16.0 mt -108.03 122.85 47.7 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.668 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.727 ' HE3' ' HB2' ' B' ' 32' ' ' ALA . 1.4 mpt? -103.35 160.88 14.31 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.49 -22.24 54.36 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.575 ' HG2' ' HB2' ' B' ' 4' ' ' SER . 1.1 mp0 -105.96 -23.23 12.71 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' B' ' 45' ' ' HIS . 0.0 OUTLIER -160.38 172.72 16.78 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.692 -0.803 . . . . 0.0 112.879 -176.582 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.932 HD12 HD13 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -112.67 122.89 67.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.742 178.3 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.727 ' HB2' ' HE3' ' B' ' 27' ' ' MET . . . -122.57 150.45 42.59 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.916 ' HB2' HD13 ' B' ' 24' ' ' LEU . 36.8 t90 -146.87 137.02 23.49 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -123.86 142.32 39.15 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.5 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.1 159.08 48.45 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.379 2.053 . . . . 0.0 111.167 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.12 137.37 57.98 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.379 -179.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.8 29.81 75.84 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.333 -0.849 . . . . 0.0 113.192 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.495 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 19.1 mmtm -113.7 151.82 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.057 0.429 . . . . 0.0 110.936 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -99.82 -12.76 19.62 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.866 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -123.49 146.41 48.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.059 0.457 . . . . 0.0 111.571 -178.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -87.06 121.64 29.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.002 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.4 p -85.84 -23.65 27.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.34 0.59 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.571 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 16.4 mm -103.42 118.74 50.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.018 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 33.4 t -147.83 101.45 3.31 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.499 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 68.9 m-70 -124.67 132.03 53.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.221 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.528 ' O ' HG12 ' B' ' 50' ' ' ILE . 81.1 mmm -81.85 143.32 31.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.458 ' CE1' HD13 ' B' ' 99' ' ' LEU . 22.3 m-30 -56.97 -24.08 50.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 110.608 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.22 -27.55 64.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.992 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.592 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -93.35 -7.16 45.57 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.021 0.438 . . . . 0.0 110.683 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.628 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.0 mm -87.88 130.64 37.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.851 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 1.5 ttpt -87.52 -37.58 16.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.298 0.571 . . . . 0.0 109.817 -179.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.851 ' SG ' ' HE2' ' B' ' 51' ' ' LYS . 21.8 p -171.89 -178.13 2.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.78 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -143.33 140.77 30.7 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.262 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.042 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.8 mttp -107.04 156.17 19.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.509 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.6 OUTLIER -131.56 131.57 62.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 176.227 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.11 120.77 66.66 Favored Pre-proline 0 C--O 1.252 1.209 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.59 172.75 12.85 Favored 'Trans proline' 0 C--O 1.233 0.246 1 C-N-CA 125.319 4.013 . . . . 0.0 114.57 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -64.04 160.48 17.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.158 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.72 -29.03 8.08 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -178.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.899 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.6 mttp -86.96 160.36 18.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.9 -9.86 59.63 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.401 0.62 . . . . 0.0 109.658 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.613 ' HD3' ' HB3' ' A' ' 399' ' ' GLU . 3.7 ptmt -134.5 129.82 35.73 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.194 -179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.465 HG21 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -83.53 131.53 33.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 177.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.584 ' CG ' ' HE2' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -137.95 163.88 30.42 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -175.366 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.509 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.5 tp -139.63 153.46 47.33 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.046 -1.888 . . . . 0.0 106.842 176.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.042 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.3 138.02 24.81 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 119.254 0.934 . . . . 0.0 111.451 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.932 HD13 HD12 ' B' ' 31' ' ' ILE . 95.8 mt -94.01 100.54 12.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.923 179.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.666 ' HA ' HG23 ' B' ' 74' ' ' THR . 5.2 t -84.14 104.34 12.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.057 -0.719 . . . . 0.0 109.057 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.609 HD23 HD12 ' B' ' 50' ' ' ILE . 2.9 mt -91.36 158.67 16.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.913 0.387 . . . . 0.0 111.408 -178.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.592 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -81.25 -0.6 41.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.163 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.77 -9.29 58.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.582 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.08 9.7 56.85 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.0 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -126.4 151.58 47.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.927 0.394 . . . . 0.0 110.861 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.666 HG23 ' HA ' ' B' ' 68' ' ' VAL . 21.8 p -121.4 130.34 53.54 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.5 m -99.02 98.65 9.67 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -83.9 143.39 29.9 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.102 0.477 . . . . 0.0 111.28 -178.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.444 ' HZ ' HG22 ' B' ' 43' ' ' ILE . 65.2 m-85 -128.85 112.8 14.51 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.131 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.559 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.2 t-160 -86.55 104.75 16.29 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.639 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.715 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 52.2 m-85 -76.45 94.32 3.65 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 5.8 p -99.28 12.82 35.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.486 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 40.3 t30 -85.09 91.94 8.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -45.93 -32.38 2.68 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.836 0.854 . . . . 0.0 112.928 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.26 -60.64 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.512 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -128.63 11.88 6.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 -176.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.715 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -42.94 -50.31 5.83 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -52.32 60.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.868 0.366 . . . . 0.0 110.91 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.512 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.45 -35.68 80.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.9 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.668 ' O ' HG21 ' B' ' 92' ' ' VAL . 14.3 mt-10 -64.75 -44.31 90.52 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.509 ' HD2' HD11 ' B' ' 55' ' ' ILE . 20.6 ttp180 -56.18 -48.64 75.97 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.6 -43.83 96.99 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.588 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.4 -42.23 83.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 117.713 0.233 . . . . 0.0 111.178 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.81 HG11 HD12 ' B' ' 26' ' ' LEU . 38.2 t -62.23 -43.85 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.423 ' HB2' HD12 ' B' ' 65' ' ' LEU . 0.6 OUTLIER -57.9 -53.98 52.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.992 178.118 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.7 -54.54 45.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.868 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.877 ' HG ' HD11 ' B' ' 99' ' ' LEU . 13.7 tp -62.08 -35.7 79.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.355 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.427 HD11 HG12 ' B' ' 92' ' ' VAL . 28.3 mt -74.41 -47.37 34.24 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . 0.458 ' O ' ' HG3' ' B' ' 97' ' ' GLN . 0.0 OUTLIER -60.29 -21.59 62.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.278 1.037 . . . . 0.0 109.136 178.682 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -87.03 -45.49 10.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.171 -1.377 . . . . 0.0 111.482 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.877 HD11 ' HG ' ' B' ' 95' ' ' LEU . 10.6 mt -85.0 -43.81 13.64 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -176.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.628 HD22 ' HB ' ' B' ' 50' ' ' ILE . 22.7 mt -51.21 -60.51 5.56 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -176.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.472 ' O ' ' HA ' ' B' ' 107' ' ' ALA . 26.1 Cg_endo -59.72 -5.76 3.83 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.496 2.131 . . . . 0.0 114.177 -177.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -85.65 -20.89 28.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.852 0.358 . . . . 0.0 110.486 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -126.52 -15.41 5.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.455 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.404 ' HD2' ' C ' ' A' ' 410' ' ' ASP . 26.8 ttmt -66.01 124.15 21.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.113 -178.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 64.82 -74.05 0.05 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.264 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' B' ' 106' ' ' LYS . 1.2 ttpm? -163.33 12.78 0.06 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 -178.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . 0.472 ' HA ' ' O ' ' B' ' 101' ' ' PRO . . . 59.44 78.27 0.27 Allowed 'General case' 0 C--O 1.234 0.237 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -177.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.422 ' C ' ' HZ2' ' B' ' 106' ' ' LYS . 3.4 t-20 . . . . . 0 C--O 1.244 0.78 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.173 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 33.6 p90 . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 17.4 t -62.63 105.28 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 111.98 -91.6 0.61 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.079 -1.208 . . . . 0.0 110.079 -178.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.509 ' OE2' ' HA ' ' A' ' 395' ' ' GLU . 3.2 tp10 -94.22 135.94 35.05 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.525 ' C ' ' H ' ' A' ' 398' ' ' GLU . 1.6 t70 -122.15 30.7 6.47 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -179.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.98 15.67 0.19 Allowed 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.361 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.525 ' H ' ' C ' ' A' ' 396' ' ' ASP . 15.2 tt0 94.78 -84.45 0.0 OUTLIER 'General case' 0 C--N 1.343 0.313 0 C-N-CA 125.293 1.437 . . . . 0.0 114.331 176.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.97 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.1 tt0 -126.0 96.83 4.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.738 0.304 . . . . 0.0 111.548 -176.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.498 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 6.9 p-10 -136.53 91.67 2.68 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.511 0.672 . . . . 0.0 111.725 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.508 ' C ' ' H ' ' A' ' 403' ' ' PHE . 26.3 p-10 -139.16 -47.4 0.48 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -71.92 9.33 0.95 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.515 0.674 . . . . 0.0 110.592 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.748 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -52.03 118.3 3.37 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . 0.529 ' O ' ' HA ' ' B' ' 54' ' ' LYS . 1.0 OUTLIER -79.43 130.42 35.4 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.509 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.622 ' HG2' ' HE3' ' B' ' 54' ' ' LYS . 1.9 mm-40 -90.15 176.67 6.68 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.494 0.664 . . . . 0.0 112.044 -178.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -155.16 146.18 22.61 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.225 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -113.22 14.89 19.46 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.569 ' HG2' ' HB2' ' B' ' 97' ' ' GLN . 0.0 OUTLIER -71.98 51.35 0.22 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.822 0.344 . . . . 0.0 111.921 -179.739 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.59 -64.3 0.91 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.469 ' HB3' ' HD2' ' B' ' 104' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.143 0 O-C-N 124.792 1.307 . . . . 0.0 109.042 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 54.1 ttm . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.42 -28.69 1.27 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.211 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 56.9 p -100.68 -165.07 1.17 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.333 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -87.92 33.1 0.72 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.374 0.606 . . . . 0.0 110.153 179.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' B' ' 6' ' ' GLU . 66.1 m -155.13 -152.64 0.41 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.706 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' B' ' 5' ' ' SER . 24.3 mt-10 78.7 24.15 0.59 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.573 0.701 . . . . 0.0 109.725 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -93.72 101.19 13.32 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.658 179.514 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.521 HG11 HG12 ' B' ' 11' ' ' ILE . 74.3 t -92.7 112.75 26.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 CA-C-O 120.905 0.383 . . . . 0.0 110.493 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.6 mt -88.86 -32.17 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.433 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.518 ' HB3' ' HB2' ' B' ' 26' ' ' LEU . 6.1 tp -129.87 123.52 31.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.59 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.521 HG12 HG11 ' B' ' 8' ' ' VAL . 56.5 mt -107.97 120.9 60.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.856 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.2 t -112.13 149.99 14.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.614 ' O ' HG21 ' B' ' 15' ' ' VAL . 2.0 mtmp? -115.9 -179.78 3.75 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.705 -178.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 18.15 63.51 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 O-C-N 125.214 1.571 . . . . 0.0 113.937 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.614 HG21 ' O ' ' B' ' 13' ' ' LYS . 25.3 t -113.73 127.09 71.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.664 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 84.0 mtt180 -100.6 126.63 47.1 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.409 0.623 . . . . 0.0 111.619 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.479 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 5.6 tp-100 -105.84 103.39 12.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.429 ' HZ3' ' CD ' ' A' ' 395' ' ' GLU . 0.6 OUTLIER 63.89 47.22 3.58 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.658 0.599 . . . . 0.0 110.16 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.418 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.4 OUTLIER 74.08 9.22 4.65 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.138 179.364 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.664 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.4 tp-100 -104.89 118.44 36.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.442 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 0.4 OUTLIER -72.11 147.5 46.63 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.328 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.557 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 178.29 -160.68 26.96 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.904 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.4 136.21 50.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.951 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.32 139.11 33.76 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.298 -179.016 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . 0.407 ' CE1' HG22 ' B' ' 11' ' ' ILE . 75.7 m-85 -132.63 109.59 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.389 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 1.001 HD11 HG13 ' B' ' 92' ' ' VAL . 9.0 mt -87.46 125.22 34.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.836 0.35 . . . . 0.0 110.892 -179.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.511 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 41.6 mtt -103.73 164.02 11.95 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.98 -39.18 71.45 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.941 ' HA ' ' HZ ' ' B' ' 103' ' ' PHE . 25.9 mm-40 -113.02 1.49 15.38 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.442 ' NH1' ' HB2' ' B' ' 29' ' ' GLU . 0.0 OUTLIER -161.76 154.61 20.43 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 119.522 -0.871 . . . . 0.0 112.76 -178.064 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.667 HD13 HD11 ' B' ' 67' ' ' LEU . 1.2 tt -102.81 118.13 49.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.56 152.2 36.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.398 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.951 ' HB2' HD11 ' B' ' 24' ' ' LEU . 38.1 t90 -147.09 134.71 21.01 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.459 ' HB2' ' CD2' ' B' ' 41' ' ' PHE . . . -120.96 129.61 25.22 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.78 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.631 ' HG2' ' HD3' ' B' ' 38' ' ' LYS . 47.4 Cg_endo -73.55 143.71 34.77 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.498 2.132 . . . . 0.0 111.7 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.557 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 63.2 mt-10 -61.64 131.2 49.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 0.0 110.856 -179.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.65 -10.62 60.96 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.834 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.631 ' HD3' ' HG2' ' B' ' 35' ' ' PRO . 5.8 mptt -113.65 152.51 30.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -100.9 -18.5 16.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.68 127.91 53.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.008 0.432 . . . . 0.0 111.816 -178.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.459 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 44.6 m-85 -63.95 121.09 13.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.56 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.38 -34.23 23.62 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.984 0.421 . . . . 0.0 110.843 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.83 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 24.2 mm -93.43 122.69 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.909 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 35.8 t -147.95 101.2 3.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.407 ' CD2' HG22 ' B' ' 43' ' ' ILE . 79.9 m-70 -127.43 140.51 52.12 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.486 ' O ' HG12 ' B' ' 50' ' ' ILE . 27.8 mtp -91.82 144.88 25.04 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.761 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.5 m-30 -60.29 -19.8 56.49 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.838 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.92 -21.53 63.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.379 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.545 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -101.51 -11.28 19.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.001 0.429 . . . . 0.0 110.6 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.807 ' HB ' HD21 ' B' ' 100' ' ' LEU . 1.5 mm -88.68 125.89 41.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.628 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 9.3 tmtt? -86.18 -38.04 18.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.03 0.443 . . . . 0.0 109.919 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.628 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 28.3 p -169.55 -177.81 2.86 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.402 -0.817 . . . . 0.0 108.917 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.11 141.94 46.12 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.751 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.09 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 26.9 mttp -102.62 146.7 27.79 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.534 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.77 126.82 69.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.174 -1.046 . . . . 0.0 108.174 177.247 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' SER . . . . . 0.447 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.56 118.5 69.09 Favored Pre-proline 0 C--O 1.249 1.062 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.76 173.03 10.65 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 125.079 3.853 . . . . 0.0 114.624 -177.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -61.69 160.51 11.5 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.395 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.02 8.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 109.606 -1.397 . . . . 0.0 109.606 -177.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.97 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 12.8 mttp -87.75 152.66 21.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.06 -11.11 60.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.212 0.529 . . . . 0.0 110.544 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.451 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.95 138.0 35.21 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.661 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.509 HG22 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -83.3 140.55 16.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 177.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.447 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 17.4 mt-30 -139.98 162.86 34.19 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 118.529 -1.269 . . . . 0.0 114.081 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -142.38 153.81 44.09 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.58 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.09 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.37 144.83 30.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 118.978 0.808 . . . . 0.0 110.328 178.025 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.667 HD11 HD13 ' B' ' 31' ' ' ILE . 96.7 mt -94.06 104.51 16.54 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.229 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.603 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 45.0 t -88.92 120.36 37.5 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.478 HD11 ' HB3' ' B' ' 73' ' ' ASP . 9.4 mt -101.93 151.78 21.71 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.112 0.482 . . . . 0.0 111.791 -177.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.545 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.2 -7.55 54.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.611 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.3 -4.79 46.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.425 -1.262 . . . . 0.0 110.875 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.73 21.53 46.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . 0.478 ' HB3' HD11 ' B' ' 69' ' ' LEU . 20.1 t70 -126.02 160.92 28.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.446 -0.377 . . . . 0.0 110.222 -179.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.573 HG22 ' HA ' ' B' ' 68' ' ' VAL . 12.0 p -142.68 131.48 22.79 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 19.9 m -110.77 107.07 16.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.266 0.226 . . . . 0.0 110.434 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.29 151.18 26.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.517 . . . . 0.0 112.318 -178.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.83 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 35.9 m-85 -134.93 115.53 13.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.606 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.605 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.0 t-160 -87.35 100.91 13.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.887 -179.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.673 ' HB3' ' HB3' ' B' ' 85' ' ' ALA . 22.9 m-85 -77.12 102.13 6.43 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.76 22.19 15.67 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.862 0.689 . . . . 0.0 112.862 -178.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.425 HD21 ' HA ' ' B' ' 81' ' ' ASN . 1.2 t-20 -89.45 97.06 10.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 110.292 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.09 -30.29 2.68 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.42 -59.53 2.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -178.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.5 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.0 p -127.38 11.05 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -175.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.673 ' HB3' ' HB3' ' B' ' 79' ' ' PHE . . . -45.63 -45.67 14.06 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.477 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.3 t -59.88 -52.67 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.803 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.5 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -67.52 -34.52 77.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.038 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.662 ' O ' HG21 ' B' ' 92' ' ' VAL . 11.1 mt-10 -65.06 -45.61 84.59 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.534 ' HD2' ' HB ' ' B' ' 55' ' ' ILE . 24.7 ttp180 -54.06 -47.79 71.27 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 122.21 1.005 . . . . 0.0 108.398 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.27 -44.98 93.59 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.514 -1.675 . . . . 0.0 112.6 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.67 90.91 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.74 0.245 . . . . 0.0 111.154 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 1.001 HG13 HD11 ' B' ' 26' ' ' LEU . 42.9 t -60.87 -44.89 98.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -57.93 -54.65 44.51 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.063 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 1.6 m-20 -55.37 -52.16 64.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.494 -1.23 . . . . 0.0 112.525 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.814 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -65.23 -28.42 69.35 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.822 -178.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 35.5 mt -78.47 -45.74 21.38 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.377 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . 0.569 ' HB2' ' HG2' ' A' ' 408' ' ' GLU . 24.7 pt20 -63.14 -18.24 63.22 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.249 1.023 . . . . 0.0 109.156 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -88.47 -47.96 7.96 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.927 -1.488 . . . . 0.0 111.057 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.814 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -83.62 -41.31 17.97 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.807 HD21 ' HB ' ' B' ' 50' ' ' ILE . 35.7 mt -51.96 -50.85 76.01 Favored Pre-proline 0 CA--C 1.54 0.596 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 21.6 Cg_exo -66.08 -23.09 53.82 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.182 1.921 . . . . 0.0 115.146 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 11.0 pttp -72.49 1.81 7.41 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.941 -0.475 . . . . 0.0 112.096 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.941 ' HZ ' ' HA ' ' B' ' 29' ' ' GLU . 30.2 m-85 -106.27 2.51 26.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.384 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.469 ' HD2' ' HB3' ' A' ' 410' ' ' ASP . 33.3 mttt -131.15 -178.39 4.81 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.768 -178.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.8 77.12 0.89 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.091 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -116.25 -66.64 1.06 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.145 178.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -123.62 18.23 9.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.854 0.359 . . . . 0.0 111.692 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.244 0.779 0 CA-C-O 118.74 -0.648 . . . . 0.0 109.75 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.423 ' HB2' ' H ' ' A' ' 393' ' ' VAL . 1.6 p90 . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 120.623 0.249 . . . . 0.0 110.701 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . 0.423 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 7.6 p -66.3 137.41 24.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.731 0.301 . . . . 0.0 110.286 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 83.7 -65.59 4.08 Favored Glycine 0 N--CA 1.451 -0.317 0 N-CA-C 111.129 -0.789 . . . . 0.0 111.129 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.501 ' OE2' ' HG2' ' B' ' 18' ' ' LYS . 7.4 tp10 -121.8 130.7 53.6 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -136.72 29.93 2.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.468 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.629 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 36.7 t70 -54.04 -41.2 67.81 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.571 -178.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.478 ' HB3' ' H ' ' A' ' 399' ' ' GLU . 0.2 OUTLIER 172.55 -102.02 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 178.35 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.523 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 3.8 pt-20 -105.04 104.34 14.05 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.765 ' HB3' HD22 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -132.77 83.91 2.1 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.758 -178.612 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.533 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.7 p-10 -138.23 -47.37 0.52 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -73.81 12.28 0.7 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.513 0.673 . . . . 0.0 110.442 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.775 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -53.78 122.13 9.31 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.884 179.44 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -86.12 135.89 33.43 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.728 ' HB2' ' HG2' ' B' ' 54' ' ' LYS . 33.4 tt0 -144.31 162.49 36.28 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 121.973 0.892 . . . . 0.0 113.373 -177.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . 0.427 ' N ' ' HG2' ' A' ' 405' ' ' GLU . 35.6 t30 -131.48 147.43 52.55 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 105.301 -2.111 . . . . 0.0 105.301 176.62 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.06 -59.59 5.12 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.941 -0.704 . . . . 0.0 111.347 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 32.56 48.5 0.12 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 124.529 1.143 . . . . 0.0 111.709 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -45.79 -48.26 15.58 Favored 'General case' 0 CA--C 1.514 -0.406 0 O-C-N 123.899 0.749 . . . . 0.0 110.2 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.604 ' HB3' ' HE3' ' B' ' 104' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.169 0 O-C-N 124.847 1.342 . . . . 0.0 112.183 178.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -166.24 -67.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.606 -179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 13.0 m -158.01 88.93 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.366 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 14.7 m 72.65 -56.17 0.66 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.656 0.782 . . . . 0.0 111.619 179.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 4.7 m -76.43 128.28 34.5 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 71.05 22.15 4.62 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.877 0.846 . . . . 0.0 109.939 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.459 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.5 OUTLIER -76.73 114.59 15.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.127 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -81.97 115.94 25.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.0 mt -96.0 -30.39 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.092 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.465 HD22 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -132.92 122.73 24.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 80.3 mt -109.13 118.36 56.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.714 HG11 ' HE2' ' B' ' 79' ' ' PHE . 2.6 t -112.22 147.79 15.77 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.641 ' O ' HG21 ' B' ' 15' ' ' VAL . 1.0 OUTLIER -109.22 -177.65 3.35 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 18.97 74.29 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 O-C-N 125.388 1.68 . . . . 0.0 112.883 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.641 HG21 ' O ' ' B' ' 13' ' ' LYS . 39.8 t -124.44 122.59 64.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.314 179.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.611 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 7.3 mtp180 -96.25 130.98 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.353 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.602 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 0.7 OUTLIER -121.42 103.38 8.9 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.612 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.501 ' HG2' ' OE2' ' A' ' 395' ' ' GLU . 5.7 mtpp 59.15 64.89 1.29 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.179 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.629 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 1.0 OUTLIER 68.93 22.89 6.9 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 176.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.644 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.9 pt20 -145.69 132.64 20.21 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.995 0.816 . . . . 0.0 110.858 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -86.23 153.76 21.78 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.07 -156.34 17.09 Favored Glycine 0 CA--C 1.522 0.516 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.756 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.31 135.11 54.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.856 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -100.69 140.85 34.38 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.481 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -135.96 109.83 8.17 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.817 0.342 . . . . 0.0 110.236 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.955 HD11 HG13 ' B' ' 92' ' ' VAL . 10.6 mt -89.0 120.84 30.78 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.53 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.459 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 36.5 mtt -102.24 161.56 13.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.043 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -28.82 57.86 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.927 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.92 -16.9 13.43 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ptp85 -158.91 162.01 36.84 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.796 -0.761 . . . . 0.0 112.822 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.889 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.07 114.81 41.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.741 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.466 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -113.56 150.36 33.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.976 0.417 . . . . 0.0 110.836 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.856 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.9 t90 -147.56 141.71 26.11 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.007 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -128.6 136.94 29.9 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.257 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.653 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 20.0 Cg_exo -64.75 158.22 51.83 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.566 2.177 . . . . 0.0 112.104 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -56.17 121.61 9.85 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.413 0.625 . . . . 0.0 112.099 -178.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.05 29.77 68.53 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.266 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.653 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.64 136.47 52.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.034 0.417 . . . . 0.0 110.358 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.4 -16.51 42.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.372 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -109.64 138.21 46.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.689 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -82.97 120.39 25.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.3 p -96.88 -6.49 35.71 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.089 0.471 . . . . 0.0 110.957 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.605 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 11.1 mm -119.88 117.32 53.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.079 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.6 t -147.9 101.33 3.29 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.43 ' CD2' HG22 ' B' ' 43' ' ' ILE . 69.9 m-70 -122.13 128.99 51.94 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.461 ' O ' HG12 ' B' ' 50' ' ' ILE . 65.4 mmm -80.04 141.11 36.18 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.582 ' HB3' HD23 ' B' ' 100' ' ' LEU . 23.1 m-85 -56.15 -24.77 43.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.941 0.4 . . . . 0.0 110.95 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.65 -29.18 65.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.121 -179.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.621 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -89.8 -4.82 57.44 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.188 0.518 . . . . 0.0 110.592 -179.041 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.507 ' HB ' HD21 ' B' ' 100' ' ' LEU . 4.4 mm -88.34 128.86 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.39 -43.73 13.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.6 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 6.7 p -161.6 -177.82 6.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.733 -178.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -142.22 143.59 32.96 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.963 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.046 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 27.6 mttp -112.92 153.44 27.98 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.578 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.7 OUTLIER -132.2 125.48 54.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.691 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -89.41 115.53 64.0 Favored Pre-proline 0 C--O 1.249 1.051 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.28 172.57 7.42 Favored 'Trans proline' 0 CA--C 1.518 -0.297 0 C-N-CA 125.155 3.903 . . . . 0.0 114.68 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.68 158.87 17.35 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.441 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.58 -29.16 8.04 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 109.841 -1.303 . . . . 0.0 109.841 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 4.2 mttm -82.36 156.26 24.32 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 176.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.19 -18.5 61.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.64 0.733 . . . . 0.0 109.271 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.41 119.63 18.81 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.104 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.518 HG12 HG21 ' B' ' 86' ' ' VAL . 3.1 mp -72.74 134.57 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -137.5 163.32 31.43 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.468 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -138.11 153.15 49.28 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 175.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.046 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -144.96 138.49 26.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 119.505 1.048 . . . . 0.0 111.478 179.043 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.889 HD11 HD13 ' B' ' 31' ' ' ILE . 94.7 mt -94.21 105.96 17.94 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.853 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.6 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -91.54 111.78 24.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.462 HD21 HD13 ' B' ' 50' ' ' ILE . 2.3 mt -100.34 158.65 15.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -176.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.621 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -77.49 -6.98 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.208 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.87 -7.79 52.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.727 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.4 15.04 57.81 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.814 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -126.22 155.46 41.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.996 0.427 . . . . 0.0 110.954 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.529 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 24.3 p -129.96 131.46 45.96 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.009 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.542 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 4.3 m -105.82 105.08 14.95 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.485 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.765 HD22 ' HB3' ' A' ' 400' ' ' ASP . 4.6 m-20 -82.09 137.65 34.98 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.548 0.689 . . . . 0.0 111.811 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.605 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.3 m-85 -125.57 102.5 7.4 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 114.653 -1.158 . . . . 0.0 108.724 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.611 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.4 t-160 -86.84 117.13 25.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.206 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.714 ' HE2' HG11 ' B' ' 12' ' ' VAL . 70.7 m-85 -83.28 94.84 8.0 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.46 1.05 54.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.528 ' O ' ' HB1' ' B' ' 85' ' ' ALA . 0.2 OUTLIER -78.17 91.08 4.3 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.038 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.57 -35.4 3.94 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 19.3 m -60.7 -60.71 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 17.9 p -128.23 15.73 6.69 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.535 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -43.68 -46.3 7.36 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.6 HG13 ' HD2' ' B' ' 87' ' ' LYS . 24.3 t -58.32 -53.09 51.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 0.0 111.574 -179.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.6 ' HD2' HG13 ' B' ' 86' ' ' VAL . 0.0 OUTLIER -75.7 -25.15 56.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.623 -178.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.608 ' O ' HG22 ' B' ' 92' ' ' VAL . 16.0 mt-10 -67.26 -40.32 86.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 176.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.522 ' NE ' HD12 ' B' ' 55' ' ' ILE . 18.5 ttp180 -59.44 -45.89 90.29 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . 0.583 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 83.6 m-20 -58.69 -48.34 81.42 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.78 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.09 -42.03 94.45 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.955 HG13 HD11 ' B' ' 26' ' ' LEU . 60.9 t -62.02 -43.39 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.583 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 11.1 ttpp -58.92 -51.93 67.93 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.942 177.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -58.75 -54.31 48.5 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.889 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.732 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.5 tp -59.61 -38.85 82.37 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.705 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.76 -42.67 70.15 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.7 -24.3 67.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 122.383 1.087 . . . . 0.0 109.008 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -85.9 -47.94 9.19 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.934 -1.485 . . . . 0.0 111.425 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.732 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -80.78 -43.02 20.79 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 115.189 1.552 . . . . 0.0 115.189 -176.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.623 ' HB2' ' HD3' ' B' ' 101' ' ' PRO . 24.7 mt -51.14 -59.89 6.76 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.623 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 29.6 Cg_exo -62.73 -16.07 50.75 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.012 1.808 . . . . 0.0 113.251 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.5 mtmm -78.69 -15.56 58.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 110.281 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -121.19 12.85 11.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.476 0.655 . . . . 0.0 109.548 179.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.604 ' HE3' ' HB3' ' A' ' 410' ' ' ASP . 17.1 mtpp -121.74 170.12 10.06 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.452 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . 0.743 ' HA ' ' CZ ' ' B' ' 105' ' ' ARG . 0.0 OUTLIER 179.59 -41.82 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -179.731 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 410' ' ' ASP . 2.5 tptp 175.91 81.16 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.475 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -101.41 14.99 30.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.555 0.693 . . . . 0.0 110.102 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 . . . . . 0 C--O 1.244 0.814 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.255 -179.628 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.404 ' HB2' ' H ' ' A' ' 393' ' ' VAL . 5.6 p90 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . 0.404 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 24.6 t -70.44 121.26 19.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 89.1 -79.39 1.61 Allowed Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -99.66 149.98 22.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.931 0.395 . . . . 0.0 110.038 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.455 ' C ' ' H ' ' A' ' 398' ' ' GLU . 15.1 t70 -136.63 15.91 3.13 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.039 -179.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.702 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 0.2 OUTLIER -76.55 16.43 0.49 Allowed 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.98 -179.367 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.702 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 2.7 mt-10 101.65 -72.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.868 1.667 . . . . 0.0 111.943 178.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.556 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER -141.97 116.55 9.68 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 120.788 0.327 . . . . 0.0 110.572 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.442 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 0.6 OUTLIER -141.14 83.27 1.87 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.267 -179.345 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.582 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.2 p-10 -138.25 -46.67 0.52 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . 0.405 ' OD1' ' HG3' ' B' ' 60' ' ' LYS . 2.3 p30 -72.97 11.58 0.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 122.047 0.927 . . . . 0.0 110.017 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.863 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -60.51 115.77 3.83 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.514 179.062 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -107.71 130.99 54.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.741 -0.208 . . . . 0.0 111.554 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.417 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 1.6 pt-20 -108.76 -108.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . 0.667 HD22 ' HG2' ' A' ' 408' ' ' GLU . 1.0 OUTLIER -152.2 -176.67 5.77 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.741 179.522 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -70.92 -34.75 71.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -176.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.667 ' HG2' HD22 ' A' ' 406' ' ' ASN . 0.1 OUTLIER -73.33 163.91 27.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.634 0.73 . . . . 0.0 112.819 -177.773 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.876 ' HA ' ' HE3' ' B' ' 51' ' ' LYS . 11.7 t0 -149.74 54.52 0.94 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.624 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.404 ' OD2' ' HG3' ' B' ' 106' ' ' LYS . 4.0 t70 . . . . . 0 C--O 1.248 0.979 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.998 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 48.6 ttp . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.28 -31.75 15.28 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.86 -165.43 1.3 Allowed 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 114.22 -1.355 . . . . 0.0 108.563 178.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -55.83 18.85 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' SER . . . . . 0.926 ' HB3' ' HB2' ' B' ' 29' ' ' GLU . 0.2 OUTLIER -179.58 54.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.351 178.339 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -112.39 -3.24 14.54 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.782 0.801 . . . . 0.0 110.438 -178.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.533 ' O ' ' HA ' ' B' ' 27' ' ' MET . 1.2 pm0 -75.55 102.02 5.11 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.829 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.548 HG22 ' HE3' ' B' ' 27' ' ' MET . 62.9 t -81.73 120.95 34.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.112 -178.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 27.9 mt -97.48 -31.83 12.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.93 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.2 tp -129.27 120.0 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.866 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.407 HG23 ' CE2' ' B' ' 25' ' ' TYR . 70.0 mt -103.9 120.93 54.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.939 -0.764 . . . . 0.0 108.939 177.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.801 HG21 HD23 ' B' ' 24' ' ' LEU . 3.3 t -111.27 149.31 14.06 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.383 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.602 ' O ' HG21 ' B' ' 15' ' ' VAL . 1.5 mtmp? -113.86 179.32 3.99 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.543 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.494 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.48 72.04 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 O-C-N 125.328 1.642 . . . . 0.0 113.22 -178.155 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.602 HG21 ' O ' ' B' ' 13' ' ' LYS . 47.6 t -117.32 124.4 72.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.907 -1.042 . . . . 0.0 108.969 178.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.609 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.2 mtp180 -97.02 129.19 44.51 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.383 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.29 103.64 8.34 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.885 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.98 45.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.243 0 O-C-N 123.767 0.667 . . . . 0.0 110.65 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.411 ' HA ' ' CZ ' ' B' ' 16' ' ' ARG . 0.0 OUTLIER 67.13 23.4 9.58 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.792 179.59 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.589 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 2.9 tp-100 -123.67 119.43 29.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.605 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.78 153.32 27.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.189 0.519 . . . . 0.0 112.349 -177.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.02 -154.49 13.02 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.602 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.45 132.1 48.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.891 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.49 141.69 30.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . 0.407 ' CE2' HG23 ' B' ' 11' ' ' ILE . 37.4 m-85 -135.23 120.33 18.79 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.938 HD13 HG13 ' B' ' 92' ' ' VAL . 14.5 mt -99.94 116.24 31.53 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.03 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.555 ' HE2' ' HB2' ' B' ' 32' ' ' ALA . 2.8 mpt? -92.92 163.48 13.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.657 178.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.78 -39.9 62.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.926 ' HB2' ' HB3' ' B' ' 5' ' ' SER . 58.5 mp0 -110.48 -5.04 15.23 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.182 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.442 ' HG2' ' HB2' ' B' ' 5' ' ' SER . 14.4 ptt-85 -161.09 158.76 28.23 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.394 -0.922 . . . . 0.0 112.587 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.897 HD11 HD13 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.83 128.98 59.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.126 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.555 ' HB2' ' HE2' ' B' ' 27' ' ' MET . . . -129.91 153.6 48.17 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.9 0.381 . . . . 0.0 110.509 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.891 ' HB2' HD12 ' B' ' 24' ' ' LEU . 36.5 t90 -147.01 141.8 26.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.425 ' HB3' ' HA ' ' B' ' 41' ' ' PHE . . . -128.25 143.91 49.81 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.866 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' B' ' 34' ' ' ALA . 17.3 Cg_exo -65.48 153.01 80.14 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.699 2.266 . . . . 0.0 111.354 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -65.32 116.11 6.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.963 0.411 . . . . 0.0 110.21 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.25 8.75 54.75 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.301 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.894 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -105.04 144.8 31.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.689 0.757 . . . . 0.0 111.57 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.02 -22.31 27.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.172 -1.376 . . . . 0.0 111.523 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -122.13 150.29 42.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 0.0 111.611 -178.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.425 ' HA ' ' HB3' ' B' ' 34' ' ' ALA . 16.0 m-85 -79.9 143.4 34.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.17 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.1 -25.31 13.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.141 0.496 . . . . 0.0 110.476 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.829 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 16.3 mm -104.01 124.95 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.385 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.6 t -148.14 101.73 3.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.49 ' CD2' HG21 ' B' ' 43' ' ' ILE . 60.2 m-70 -130.25 138.43 50.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.52 ' O ' HG12 ' B' ' 50' ' ' ILE . 30.6 mtp -90.83 145.28 24.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.629 ' HB3' HD21 ' B' ' 100' ' ' LEU . 22.0 m-85 -57.84 -24.1 55.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.667 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.63 -26.2 64.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.876 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.558 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.96 -7.48 36.41 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.993 0.425 . . . . 0.0 110.735 -179.436 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.625 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -86.9 127.44 40.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.876 ' HE3' ' HA ' ' A' ' 409' ' ' ASP . 0.2 OUTLIER -81.38 -40.38 23.57 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.178 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.528 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 31.8 p -173.28 -177.84 1.6 Allowed 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.459 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . 0.506 HE22 HD13 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -137.71 139.34 40.11 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.909 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.065 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -102.76 151.4 22.44 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.566 HG23 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -128.03 128.98 69.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 175.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -90.05 114.08 59.56 Favored Pre-proline 0 C--O 1.249 1.068 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -68.67 172.94 10.71 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 125.103 3.869 . . . . 0.0 114.492 -177.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -58.98 157.86 9.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.035 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.32 -29.03 8.21 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.556 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 4.1 mttm -85.28 160.09 19.92 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.1 -13.35 59.35 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.688 ' HB3' ' CD2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -131.72 127.75 37.49 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.568 -179.329 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.59 HG21 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -78.11 125.0 37.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 176.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -133.44 163.58 29.05 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -175.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.598 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -140.56 153.32 46.08 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 113.659 -1.609 . . . . 0.0 107.52 176.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.065 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.62 145.48 30.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 119.273 0.942 . . . . 0.0 111.141 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.897 HD13 HD11 ' B' ' 31' ' ' ILE . 73.1 mt -96.27 106.22 18.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.026 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.569 ' HA ' HG21 ' B' ' 74' ' ' THR . 10.6 t -93.25 121.87 44.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 mt -108.36 154.35 21.96 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -177.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.558 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.34 -5.73 46.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.747 0.784 . . . . 0.0 108.94 178.274 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.43 -4.11 43.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.559 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.57 21.04 55.19 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.371 -0.692 . . . . 0.0 111.371 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.05 157.3 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.514 -0.343 . . . . 0.0 110.533 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.569 HG21 ' HA ' ' B' ' 68' ' ' VAL . 19.8 p -139.86 131.03 26.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.546 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.3 102.68 11.78 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.464 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -82.36 139.14 34.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.338 0.589 . . . . 0.0 111.637 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.829 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 53.5 m-85 -129.53 110.92 12.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.012 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.688 ' CD2' ' HB3' ' B' ' 62' ' ' LYS . 5.3 t-160 -87.51 121.24 29.7 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.01 179.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.771 ' HB3' ' HB2' ' B' ' 85' ' ' ALA . 42.4 m-85 -85.03 93.6 8.63 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.5 13.68 25.22 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.494 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.0 OUTLIER -86.08 94.27 9.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.316 0.579 . . . . 0.0 110.513 179.47 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.74 -31.05 1.81 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -178.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.05 -59.52 2.7 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -178.191 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.512 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.3 p -127.32 14.16 7.16 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -176.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.771 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -45.36 -49.66 12.83 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.404 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.14 -51.4 73.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 110.876 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.512 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.6 mttt -66.38 -34.53 78.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.054 0.454 . . . . 0.0 109.979 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.599 ' O ' HG22 ' B' ' 92' ' ' VAL . 12.0 mt-10 -65.84 -44.81 84.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.59 ' HD3' HG21 ' B' ' 63' ' ' ILE . 23.1 ttp180 -55.61 -45.33 77.51 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . 0.688 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -63.56 -45.79 88.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.733 -1.576 . . . . 0.0 112.519 179.676 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.22 81.85 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.924 0.329 . . . . 0.0 111.421 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.938 HG13 HD13 ' B' ' 26' ' ' LEU . 45.3 t -62.79 -39.38 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.688 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.6 OUTLIER -62.17 -56.89 14.18 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.563 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.09 -53.89 46.93 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.801 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.788 ' HG ' HD13 ' B' ' 99' ' ' LEU . 13.1 tp -61.64 -39.42 91.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.202 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.7 mt -69.47 -45.17 69.63 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 117.946 0.339 . . . . 0.0 110.366 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -64.24 -18.63 64.73 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.851 0.834 . . . . 0.0 109.475 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -85.88 -51.36 6.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.901 178.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.788 HD13 ' HG ' ' B' ' 95' ' ' LEU . 15.2 mt -76.0 -46.76 27.85 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.415 -1.721 . . . . 0.0 115.361 -176.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.629 HD21 ' HB3' ' B' ' 47' ' ' TYR . 31.5 mt -50.39 -60.15 5.85 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -61.74 -14.48 36.47 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.008 1.805 . . . . 0.0 113.146 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 20.3 mtmm -86.97 -14.51 41.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.17 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -117.3 -18.25 9.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.599 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 15.2 mtpt -60.93 108.55 0.88 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.806 0.336 . . . . 0.0 110.232 179.238 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . 0.494 ' HE ' ' HA ' ' B' ' 105' ' ' ARG . 9.9 mmp_? -107.24 54.63 0.67 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.452 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.454 ' HB2' ' HE2' ' B' ' 106' ' ' LYS . 12.7 ptmm? -148.34 166.93 26.57 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.37 -0.377 . . . . 0.0 109.988 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -154.19 23.2 0.49 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.428 0.632 . . . . 0.0 109.486 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.0 t30 . . . . . 0 C--O 1.245 0.829 0 CA-C-N 114.591 -1.186 . . . . 0.0 108.773 -179.241 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.478 ' O ' ' HB ' ' A' ' 393' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.624 0.249 . . . . 0.0 111.036 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . 0.478 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 93.2 t 78.09 123.38 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.058 0.543 . . . . 0.0 110.441 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 84.82 -57.88 5.0 Favored Glycine 0 CA--C 1.509 -0.317 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.414 ' CD ' ' HZ1' ' B' ' 18' ' ' LYS . 6.8 tp10 -119.59 113.81 21.27 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 106.519 -1.66 . . . . 0.0 106.519 176.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -134.39 31.8 3.43 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.729 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 27.8 t70 -40.54 -34.99 0.4 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.407 ' HB3' ' H ' ' A' ' 399' ' ' GLU . 0.4 OUTLIER 174.28 -86.28 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.848 0.356 . . . . 0.0 111.454 178.434 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.957 ' HG2' ' HE2' ' B' ' 62' ' ' LYS . 3.9 pt-20 -120.47 112.87 19.5 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.841 ' HB3' HD22 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -143.55 84.53 1.8 Allowed 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.132 -0.627 . . . . 0.0 112.537 -177.244 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.535 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.7 p-10 -139.15 -45.67 0.47 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -72.37 11.06 0.65 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 110.271 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.869 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.02 112.55 1.55 Allowed 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.414 179.24 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -99.69 135.93 40.38 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.411 -177.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.994 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 17.9 pt-20 -143.07 161.67 37.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.585 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . 0.538 ' HA ' ' OE1' ' A' ' 408' ' ' GLU . 1.1 t-20 -169.95 35.42 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -112.94 -6.43 13.77 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.404 -1.271 . . . . 0.0 109.7 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.551 ' HA ' ' HB3' ' B' ' 52' ' ' CYS . 5.5 pm0 -60.38 144.78 50.04 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 -178.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.608 ' OD1' ' HG3' ' B' ' 51' ' ' LYS . 18.1 p-10 -103.99 -166.09 1.22 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 105.935 -1.876 . . . . 0.0 105.935 175.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.425 ' CG ' ' HZ2' ' B' ' 106' ' ' LYS . 7.9 p-10 . . . . . 0 C--N 1.314 -0.958 0 CA-C-N 118.681 0.673 . . . . 0.0 110.173 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 49.7 ttp . . . . . 0 N--CA 1.476 0.875 0 CA-C-O 120.505 0.193 . . . . 0.0 110.828 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.74 -77.85 0.05 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.962 0.411 . . . . 0.0 110.803 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 19.9 m -155.52 105.29 2.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.818 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 7.8 m 62.12 29.98 17.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.253 0.549 . . . . 0.0 110.55 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.0 95.11 2.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.336 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 70.5 41.6 0.95 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 122.013 0.911 . . . . 0.0 108.543 -178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.559 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.2 OUTLIER -96.77 102.99 14.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.094 -179.632 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 88.5 t -81.76 114.01 22.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.535 HD12 HD12 ' B' ' 99' ' ' LEU . 22.7 mt -95.29 -29.01 14.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.264 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.444 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -137.4 137.3 38.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.055 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 75.5 mt -122.85 115.96 47.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.681 HG21 HD22 ' B' ' 24' ' ' LEU . 3.0 t -104.93 149.25 8.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.09 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.532 ' O ' HG22 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.08 173.21 6.42 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.57 -179.177 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.576 ' HE3' ' HA ' ' B' ' 81' ' ' ASN . 22.1 mtmt 18.23 82.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 125.341 1.651 . . . . 0.0 113.471 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.532 HG22 ' O ' ' B' ' 13' ' ' LYS . 31.6 t -129.02 123.6 59.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.186 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.612 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 6.8 mtp-105 -98.61 141.27 31.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.213 0.53 . . . . 0.0 112.22 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -132.5 103.43 6.17 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 177.096 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.622 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 59.4 mttp 65.09 56.54 1.02 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.026 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.729 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 2.8 mptp? 68.83 23.93 6.69 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.155 177.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.562 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 10.4 tt0 -135.83 119.72 17.41 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.65 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -81.94 153.15 26.42 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.821 0.344 . . . . 0.0 111.72 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.614 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -177.38 -158.36 20.33 Favored Glycine 0 CA--C 1.521 0.433 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.186 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.42 136.83 54.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.126 0.488 . . . . 0.0 110.648 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.936 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.3 139.7 35.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.128 -178.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.45 125.72 29.63 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.86 HD11 HG11 ' B' ' 92' ' ' VAL . 16.9 mt -107.94 117.34 33.87 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.476 -0.489 . . . . 0.0 111.128 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.559 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.2 mpt? -97.49 159.68 14.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.14 -27.83 55.64 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.101 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.976 ' HA ' ' HE2' ' B' ' 103' ' ' PHE . 0.9 OUTLIER -103.07 -25.12 13.53 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.13 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.477 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -157.97 169.86 23.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.915 -175.989 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.891 HD13 HD13 ' B' ' 67' ' ' LEU . 1.5 tt -110.79 122.14 64.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.661 178.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.494 ' HB2' ' HE3' ' B' ' 27' ' ' MET . . . -123.17 149.82 44.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.011 0.434 . . . . 0.0 110.599 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.936 ' HB2' HD12 ' B' ' 24' ' ' LEU . 39.7 t90 -146.68 134.07 20.75 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -122.92 131.46 24.36 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.334 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.614 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 9.3 Cg_exo -70.3 160.0 51.08 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.536 2.157 . . . . 0.0 111.353 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 145.26 55.78 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.918 0.39 . . . . 0.0 109.972 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.35 24.87 74.93 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.555 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' B' ' 38' ' ' LYS . 25.3 mmtm -114.19 153.36 29.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.587 0.232 . . . . 0.0 110.579 179.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -106.39 5.02 29.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.556 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -151.73 160.18 43.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.24 -179.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -86.1 125.71 33.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.083 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 3.0 p -90.64 -22.48 21.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.29 0.567 . . . . 0.0 110.328 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.635 HG23 ' HZ ' ' B' ' 77' ' ' PHE . 17.8 mm -107.46 118.62 55.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.111 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -147.93 101.58 3.31 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 59.1 m-70 -127.74 134.87 49.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.281 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.488 ' O ' HG12 ' B' ' 50' ' ' ILE . 84.0 mmm -84.79 143.07 29.35 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.705 ' HB2' ' HD2' ' B' ' 103' ' ' PHE . 22.7 m-30 -57.28 -22.69 43.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.83 0.348 . . . . 0.0 111.294 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.19 -26.87 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.893 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.64 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.6 OUTLIER -94.28 -4.21 49.19 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 110.6 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.578 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.7 mm -90.35 128.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.608 ' HG3' ' OD1' ' A' ' 409' ' ' ASP . 51.4 tttp -85.43 -40.68 16.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.396 0.617 . . . . 0.0 109.452 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.581 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.8 p -168.59 -177.62 3.18 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.291 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -143.06 139.57 30.56 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.313 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.994 ' HG2' ' HB3' ' A' ' 405' ' ' GLU . 53.2 mttp -106.99 161.44 14.72 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.649 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -133.07 130.15 57.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 175.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' SER . . . . . 0.528 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -91.27 118.0 68.2 Favored Pre-proline 0 C--O 1.25 1.086 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.66 173.08 11.4 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 124.966 3.778 . . . . 0.0 114.011 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -59.95 160.84 7.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.161 178.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.23 -28.76 8.09 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -177.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.569 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 14.5 mttp -89.52 158.29 17.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 176.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.96 -5.71 42.95 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.241 0.543 . . . . 0.0 110.485 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.957 ' HE2' ' HG2' ' A' ' 399' ' ' GLU . 0.7 OUTLIER -142.78 146.69 34.49 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.049 -179.558 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.661 HG21 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -90.61 131.47 37.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.528 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 24.5 mt-30 -131.9 163.16 28.93 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.511 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -140.82 153.45 45.8 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.417 -1.719 . . . . 0.0 106.642 175.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 0.941 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.47 142.39 28.05 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 119.149 0.886 . . . . 0.0 111.875 179.135 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.891 HD13 HD13 ' B' ' 31' ' ' ILE . 89.6 mt -94.33 104.49 16.47 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.928 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.634 ' HA ' HG23 ' B' ' 74' ' ' THR . 4.1 t -90.14 114.39 27.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.533 HD23 HD13 ' B' ' 50' ' ' ILE . 4.0 mt -100.75 155.64 17.8 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -177.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.64 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -77.69 -3.46 41.23 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.279 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.94 -7.33 56.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.259 179.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.04 17.59 50.49 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.866 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -126.25 160.29 30.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.698 0.285 . . . . 0.0 110.8 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.634 HG23 ' HA ' ' B' ' 68' ' ' VAL . 21.2 p -137.71 131.73 31.79 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.55 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.4 m -106.48 109.57 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.41 0.148 . . . . 0.0 111.302 -179.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.841 HD22 ' HB3' ' A' ' 400' ' ' ASP . 5.6 m-20 -82.29 147.29 28.97 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.742 0.782 . . . . 0.0 112.19 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.635 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 43.1 m-85 -134.51 103.5 5.71 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.743 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.612 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.6 t-160 -86.46 107.78 18.22 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.513 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.67 ' CE2' HG11 ' B' ' 12' ' ' VAL . 54.2 m-85 -76.26 94.37 3.55 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.158 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.04 5.16 47.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.891 -178.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.576 ' HA ' ' HE3' ' B' ' 14' ' ' LYS . 46.4 t30 -85.98 91.13 8.29 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . 0.509 ' CD ' ' HZ1' ' B' ' 14' ' ' LYS . 0.7 OUTLIER -51.66 -29.09 16.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.543 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 2.1 m -60.13 -60.21 4.18 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.51 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.9 p -128.34 12.76 6.54 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.652 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -43.7 -50.04 7.68 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.42 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -58.34 -52.44 59.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.848 0.356 . . . . 0.0 110.869 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.51 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.4 mttt -66.4 -37.33 84.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.052 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.677 ' O ' HG21 ' B' ' 92' ' ' VAL . 13.8 mt-10 -63.95 -43.55 95.49 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.661 ' HD3' HG21 ' B' ' 63' ' ' ILE . 28.4 ttp180 -56.63 -49.67 74.29 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . 0.517 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -59.85 -43.3 94.7 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.635 -1.62 . . . . 0.0 112.225 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -43.47 74.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.675 0.216 . . . . 0.0 111.27 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.86 HG11 HD11 ' B' ' 26' ' ' LEU . 40.2 t -61.02 -42.72 94.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.649 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.3 tmmt? -59.34 -58.66 7.65 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.722 178.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.31 -53.91 44.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.158 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.542 ' HG ' ' CD1' ' B' ' 99' ' ' LEU . 10.7 tp -62.12 -37.13 83.95 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.182 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.45 HD12 HG12 ' B' ' 92' ' ' VAL . 26.0 mt -73.34 -41.01 63.97 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.7 -19.96 59.93 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.197 0.998 . . . . 0.0 108.971 178.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -93.86 -51.9 4.68 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.813 -1.54 . . . . 0.0 111.043 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.645 ' HB3' ' CE1' ' B' ' 47' ' ' TYR . 42.4 mt -75.75 -28.41 58.48 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.494 -1.685 . . . . 0.0 115.432 -176.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.578 HD22 ' HB ' ' B' ' 50' ' ' ILE . 36.4 mt -72.5 -58.18 3.08 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 18.6 Cg_endo -57.59 -19.18 35.98 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.542 2.162 . . . . 0.0 114.178 -177.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.575 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 17.9 pttm -80.5 -11.98 59.6 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.172 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.976 ' HE2' ' HA ' ' B' ' 29' ' ' GLU . 17.5 m-30 -124.09 -0.16 8.4 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.772 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 81.7 mttt -67.94 100.57 0.98 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.529 0.68 . . . . 0.0 112.182 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 53.0 ttp85 -107.44 11.52 28.83 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.694 178.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.425 ' HZ2' ' CG ' ' A' ' 410' ' ' ASP . 27.5 mtpp 73.03 0.36 3.66 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.049 -178.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -178.42 -176.44 0.5 Allowed 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.454 -1.248 . . . . 0.0 107.941 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.84 -0.6 . . . . 0.0 109.683 179.649 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.587 ' HD2' ' HB2' ' A' ' 396' ' ' ASP . 63.0 t80 . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 120.741 0.305 . . . . 0.0 111.049 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 22.3 t -134.13 -84.11 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -89.29 -27.17 23.72 Favored Glycine 0 CA--C 1.505 -0.57 0 N-CA-C 107.345 -2.302 . . . . 0.0 107.345 176.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' A' ' 392' ' ' TYR . 0.0 OUTLIER -146.55 -167.53 2.78 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 177.755 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.587 ' HB2' ' HD2' ' A' ' 392' ' ' TYR . 41.4 t0 -136.56 30.37 2.89 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 119.122 -1.031 . . . . 0.0 111.756 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.593 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 0.5 OUTLIER -62.91 -26.69 68.92 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 119.255 -0.978 . . . . 0.0 108.382 177.825 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.729 ' HB3' ' HE3' ' B' ' 62' ' ' LYS . 3.1 tt0 167.48 -78.46 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.551 177.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.885 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 57.7 tt0 -135.27 103.11 5.39 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -178.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.547 ' HB3' HD22 ' B' ' 76' ' ' ASN . 0.2 OUTLIER -135.94 91.27 2.67 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.484 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.09 -45.22 0.47 Allowed 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -72.05 8.22 1.35 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.269 0.557 . . . . 0.0 110.774 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.937 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -52.99 120.05 5.39 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.75 179.426 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -99.96 142.59 31.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.352 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -127.2 150.72 49.4 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.165 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -158.54 23.22 0.23 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.066 0.46 . . . . 0.0 110.818 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . 0.597 ' OD1' ' HB3' ' B' ' 52' ' ' CYS . 1.2 t70 -93.25 -24.63 18.1 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.298 -178.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' A' ' 409' ' ' ASP . 3.9 mm-40 52.16 -114.67 0.84 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -178.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.501 ' HB2' ' O ' ' A' ' 408' ' ' GLU . 0.8 OUTLIER 167.98 -57.01 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.429 0 O-C-N 123.782 0.676 . . . . 0.0 109.959 177.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.903 -1.046 . . . . 0.0 109.782 179.205 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.496 ' HA ' ' HE1' ' B' ' 1' ' ' MET . 6.4 tpt . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.47 -74.04 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.42 -48.1 3.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.352 0.596 . . . . 0.0 109.458 178.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 28.3 m -159.27 100.5 1.52 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' SER . . . . . 0.493 ' HB3' ' HB2' ' B' ' 29' ' ' GLU . 0.0 OUTLIER -143.56 34.39 1.29 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.724 0.297 . . . . 0.0 111.212 -178.76 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' B' ' 1' ' ' MET . 13.1 mp0 -129.88 18.34 5.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.763 0.792 . . . . 0.0 109.829 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.505 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -119.54 117.09 27.46 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.209 -178.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -82.53 117.44 28.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.009 0.433 . . . . 0.0 110.755 -179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.3 mt -95.67 -31.66 13.14 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.301 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.449 HD21 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -131.37 129.3 41.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.923 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.421 HG21 ' CE1' ' B' ' 25' ' ' TYR . 73.1 mt -113.82 122.68 68.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.841 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.6 t -113.59 150.27 15.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.629 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.7 mtmp? -116.67 178.6 4.28 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.441 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.486 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 1.2 mmtm 18.45 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 O-C-N 125.2 1.562 . . . . 0.0 113.422 -178.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.629 HG23 ' O ' ' B' ' 13' ' ' LYS . 24.7 t -124.01 125.11 70.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.139 179.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.62 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.8 mpt_? -93.75 132.78 37.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.92 0.39 . . . . 0.0 110.629 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.409 ' HG3' HG13 ' B' ' 43' ' ' ILE . 5.2 tm0? -129.59 113.74 15.19 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.474 ' HD3' ' HA ' ' B' ' 18' ' ' LYS . 0.5 OUTLIER 66.4 41.03 3.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.952 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.502 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 2.2 mptp? 68.52 29.94 5.4 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.051 179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.585 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.6 tp-100 -131.23 126.64 36.02 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.525 ' HA ' ' HG3' ' B' ' 16' ' ' ARG . 9.3 t0 -73.95 146.57 43.8 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.59 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -179.1 -164.69 32.18 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.656 -0.783 . . . . 0.0 113.84 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.46 136.6 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.182 0.593 . . . . 0.0 109.43 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.842 HD11 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -99.13 143.64 29.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.993 -178.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . 0.421 ' CE1' HG21 ' B' ' 11' ' ' ILE . 34.3 m-85 -137.57 115.56 11.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.82 0.343 . . . . 0.0 110.173 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.875 HD11 HG13 ' B' ' 92' ' ' VAL . 13.0 mt -94.25 128.41 40.69 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.772 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.505 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 18.8 mtt -106.44 167.98 9.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.775 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.87 65.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -176.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.493 ' HB2' ' HB3' ' B' ' 5' ' ' SER . 61.0 mt-10 -121.67 4.31 10.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.445 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.2 OUTLIER -157.84 156.59 31.71 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 119.29 -0.964 . . . . 0.0 112.68 -177.931 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.958 HD11 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -109.08 120.86 61.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 108.592 178.449 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.433 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.04 150.57 40.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.495 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.842 ' HB2' HD11 ' B' ' 24' ' ' LEU . 29.7 t90 -147.12 135.53 21.79 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.422 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -123.74 134.41 25.29 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.137 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 1.03 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -72.48 144.93 41.47 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 122.314 2.01 . . . . 0.0 111.591 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.454 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 32.2 mt-10 -64.45 129.24 39.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.157 0.503 . . . . 0.0 110.648 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.5 1.38 64.17 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.05 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 1.03 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.0 mptt -113.34 151.64 30.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.632 0.253 . . . . 0.0 110.327 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -100.15 8.09 44.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.887 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -138.97 151.67 47.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.131 0.491 . . . . 0.0 112.077 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -86.0 121.36 28.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.585 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -16.12 29.24 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.232 0.539 . . . . 0.0 110.529 179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.658 HG22 ' HZ ' ' B' ' 77' ' ' PHE . 18.9 mm -113.65 118.91 59.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.752 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.3 t -148.03 101.21 3.27 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.471 ' CD2' HG23 ' B' ' 43' ' ' ILE . 54.5 m-70 -128.12 138.58 52.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.528 ' O ' HG12 ' B' ' 50' ' ' ILE . 61.6 mmm -88.33 143.64 26.89 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.739 ' HB3' HD22 ' B' ' 100' ' ' LEU . 22.2 m-85 -59.84 -21.71 61.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 110.305 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.15 -15.3 61.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.482 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.6 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.33 -10.48 18.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.29 0.567 . . . . 0.0 109.52 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.752 ' HB ' HD23 ' B' ' 100' ' ' LEU . 1.6 mm -90.31 126.29 43.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.435 ' HZ2' ' HB3' ' B' ' 52' ' ' CYS . 0.1 OUTLIER -86.67 -41.0 14.56 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.286 0.565 . . . . 0.0 110.063 -179.085 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.624 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -160.71 -177.83 6.44 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.574 -179.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.48 140.47 26.25 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.798 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.046 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.7 mttp -105.15 156.85 17.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.727 HG23 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -132.08 126.85 57.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.414 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -90.52 118.88 69.06 Favored Pre-proline 0 C--O 1.247 0.935 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.54 172.8 11.78 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 124.67 3.58 . . . . 0.0 114.34 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -60.79 160.99 8.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.326 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.52 -29.19 7.72 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -177.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.885 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.4 mttp -89.03 146.69 24.69 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 175.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.73 -4.22 18.82 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.359 0.599 . . . . 0.0 110.392 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.729 ' HE3' ' HB3' ' A' ' 398' ' ' GLU . 16.1 pttm -139.54 125.6 19.87 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.181 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mp -78.21 137.69 21.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -136.4 163.2 31.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.55 HD13 ' HG2' ' B' ' 89' ' ' ARG . 1.1 tp -141.66 153.44 44.72 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.442 177.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.046 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.29 143.62 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 178.65 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.958 HD11 HD11 ' B' ' 31' ' ' ILE . 97.1 mt -97.62 106.01 18.25 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.969 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.624 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 18.5 t -90.35 111.82 23.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.501 HD21 HD12 ' B' ' 50' ' ' ILE . 6.6 mt -93.98 156.5 16.58 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.081 0.467 . . . . 0.0 112.203 -177.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.6 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.66 -3.45 44.11 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.247 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.26 -4.59 53.86 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.578 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.36 19.98 53.42 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -126.09 158.23 35.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.564 -0.318 . . . . 0.0 110.406 -179.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.569 HG23 ' HA ' ' B' ' 68' ' ' VAL . 16.6 p -136.0 131.53 35.13 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.6 m -107.23 108.47 19.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.188 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.547 HD22 ' HB3' ' A' ' 400' ' ' ASP . 4.8 m-20 -82.13 154.66 25.42 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.291 0.567 . . . . 0.0 112.001 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.658 ' HZ ' HG22 ' B' ' 43' ' ' ILE . 44.3 m-85 -140.5 111.39 6.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.979 -1.009 . . . . 0.0 109.511 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.62 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.2 t-160 -88.56 104.84 17.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.607 -179.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.685 ' HZ ' HG23 ' B' ' 92' ' ' VAL . 41.6 m-85 -80.43 108.98 14.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 4.4 p -116.7 5.87 13.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.486 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -77.8 91.62 4.13 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.807 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.55 -38.64 1.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.966 0.906 . . . . 0.0 113.367 -178.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -58.26 -59.66 4.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.526 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.82 9.01 6.35 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -176.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.496 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -43.52 -48.3 7.38 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -177.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.43 -52.61 58.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.824 0.345 . . . . 0.0 110.644 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.526 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.4 mttt -67.01 -32.67 74.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.152 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.626 ' O ' HG21 ' B' ' 92' ' ' VAL . 11.5 mt-10 -65.46 -46.12 81.07 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.572 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 4.1 tmm_? -57.94 -40.78 81.34 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . 0.514 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 1.6 m-20 -64.91 -47.36 78.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.016 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.35 -43.57 81.17 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.875 HG13 HD11 ' B' ' 26' ' ' LEU . 41.5 t -61.0 -41.17 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 177.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.727 ' HG3' HG23 ' B' ' 55' ' ' ILE . 1.5 tmmt? -61.32 -57.25 13.1 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.414 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -55.8 15.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.143 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.808 ' HG ' HD11 ' B' ' 99' ' ' LEU . 12.1 tp -62.04 -31.19 71.57 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.568 -178.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 23.0 mt -78.63 -43.99 24.95 Favored 'General case' 0 C--O 1.218 -0.6 0 O-C-N 122.219 -0.301 . . . . 0.0 110.749 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' B' ' 93' ' ' LYS . 21.0 mt-30 -65.56 -17.85 64.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.098 0.951 . . . . 0.0 108.87 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -87.61 -49.56 7.09 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.63 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.808 HD11 ' HG ' ' B' ' 95' ' ' LEU . 12.4 mt -81.49 -33.49 31.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 115.401 1.63 . . . . 0.0 115.401 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.752 HD23 ' HB ' ' B' ' 50' ' ' ILE . 58.8 mt -66.82 -57.27 11.95 Favored Pre-proline 0 C--N 1.317 -0.814 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.635 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 39.4 Cg_exo -58.73 -20.62 52.13 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.399 2.066 . . . . 0.0 114.211 -178.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.778 ' HB2' ' HB3' ' B' ' 108' ' ' ASN . 7.2 ptmm? -81.77 -19.72 40.7 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.537 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.434 ' HD1' ' HB2' ' B' ' 47' ' ' TYR . 24.0 m-85 -105.01 -35.97 7.47 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.428 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.477 ' HG2' ' HA ' ' B' ' 101' ' ' PRO . 51.3 pttt -77.05 122.38 24.87 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 177.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' B' ' 104' ' ' LYS . 62.5 mtt180 73.72 -5.8 1.93 Allowed 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -177.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' B' ' 104' ' ' LYS . 9.2 tptp 54.58 71.24 0.54 Allowed 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.367 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' B' ' 108' ' ' ASN . . . -97.26 10.48 39.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.303 0.573 . . . . 0.0 110.408 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.778 ' HB3' ' HB2' ' B' ' 102' ' ' LYS . 7.0 t-20 . . . . . 0 C--O 1.251 1.153 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.422 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.702 ' HA ' ' OD1' ' A' ' 400' ' ' ASP . 7.8 t80 . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . 0.531 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 68.9 t 84.69 -35.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.721 0.808 . . . . 0.0 110.73 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -77.46 -35.42 37.09 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.021 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 1.007 ' HG2' ' HB2' ' B' ' 76' ' ' ASN . 5.5 tp10 -139.49 159.43 42.18 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.632 ' OD1' ' HE3' ' B' ' 18' ' ' LYS . 0.5 OUTLIER -101.52 10.29 40.48 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.815 ' H ' ' HG3' ' A' ' 395' ' ' GLU . 0.5 OUTLIER -64.68 17.39 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -177.719 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.695 ' HG3' ' HD2' ' B' ' 19' ' ' LYS . 81.5 mt-10 91.18 -41.92 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.72 1.208 . . . . 0.0 112.27 178.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.817 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.5 mt-10 -151.36 150.36 30.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.726 0.298 . . . . 0.0 111.799 -178.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.82 ' HB3' HD22 ' B' ' 76' ' ' ASN . 9.6 p-10 177.86 77.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.643 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.51 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.98 -51.19 0.6 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.412 -0.805 . . . . 0.0 112.964 -178.256 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.53 9.85 0.97 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.315 0.579 . . . . 0.0 110.331 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.867 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -51.92 127.3 20.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.183 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -97.34 134.53 40.49 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.85 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.503 ' CD ' ' HZ2' ' B' ' 54' ' ' LYS . 9.6 tt0 -128.48 140.11 51.98 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.337 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -167.36 42.58 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.734 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . 0.445 ' HB3' ' HB2' ' B' ' 52' ' ' CYS . 6.8 t70 -112.24 -32.8 6.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.235 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.427 ' HB3' ' H ' ' A' ' 409' ' ' ASP . 0.5 OUTLIER 44.78 -149.24 0.07 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.995 179.11 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.427 ' H ' ' HB3' ' A' ' 408' ' ' GLU . 0.0 OUTLIER 169.93 -36.15 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.049 179.415 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.529 ' CG ' ' HZ3' ' B' ' 51' ' ' LYS . 3.3 m-20 . . . . . 0 C--O 1.253 1.282 0 CA-C-O 117.864 -1.065 . . . . 0.0 111.299 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.68 ' HG3' ' HG2' ' B' ' 6' ' ' GLU . 18.3 ptm . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . 0.6 ' HA ' ' NH2' ' B' ' 30' ' ' ARG . . . -86.05 113.16 21.91 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.919 0.39 . . . . 0.0 111.495 -179.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 26.3 m -145.93 -57.24 0.3 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.447 178.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.43 ' H ' ' CD ' ' B' ' 6' ' ' GLU . 3.0 p -152.25 -80.15 0.1 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.995 0.426 . . . . 0.0 110.604 179.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 22.8 m -137.85 82.53 1.92 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.68 ' HG2' ' HG3' ' B' ' 1' ' ' MET . 18.5 mp0 -102.08 -133.35 0.29 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.438 -177.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -45.88 101.73 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 45.5 t -94.63 108.21 20.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.71 -29.56 25.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.617 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.468 HD21 ' HG ' ' B' ' 26' ' ' LEU . 7.2 tp -136.12 132.76 36.5 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.41 HG21 ' CE1' ' B' ' 25' ' ' TYR . 60.3 mt -117.2 120.79 66.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.78 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.9 t -112.75 148.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.406 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.59 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.47 175.95 5.26 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.285 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.558 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.17 78.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 O-C-N 125.422 1.701 . . . . 0.0 113.667 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.59 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.8 t -129.04 125.54 62.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.798 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.63 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 38.6 mtp180 -99.68 138.2 37.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.245 0.545 . . . . 0.0 111.502 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.406 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -124.92 114.27 18.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 176.714 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.632 ' HE3' ' OD1' ' A' ' 396' ' ' ASP . 0.0 OUTLIER 68.64 31.34 4.68 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.79 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.695 ' HD2' ' HG3' ' A' ' 398' ' ' GLU . 0.0 OUTLIER 76.24 13.06 2.63 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 114.343 -1.298 . . . . 0.0 112.148 -179.763 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.63 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 5.7 tp-100 -105.85 118.9 37.79 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -77.27 149.98 35.36 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 -177.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.665 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -178.39 -155.39 14.3 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.817 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.85 137.6 51.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.139 0.495 . . . . 0.0 110.156 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.935 HD11 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.47 138.97 34.09 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.006 -178.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . 0.41 ' CE1' HG21 ' B' ' 11' ' ' ILE . 61.9 m-85 -134.06 110.14 9.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.68 0.276 . . . . 0.0 110.338 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.886 HD13 HG11 ' B' ' 92' ' ' VAL . 10.8 mt -87.71 129.0 35.3 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.069 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 21.7 mtt -109.27 169.1 8.91 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.968 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.88 -50.61 14.22 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -115.29 6.53 14.96 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.6 ' NH2' ' HA ' ' B' ' 2' ' ' ALA . 0.7 OUTLIER -158.42 157.6 32.58 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 119.532 -0.867 . . . . 0.0 112.86 -178.083 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.768 HD11 HD12 ' B' ' 67' ' ' LEU . 1.3 tt -106.77 116.47 50.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 178.049 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -117.97 151.75 36.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.988 0.423 . . . . 0.0 111.044 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.935 ' HB2' HD11 ' B' ' 24' ' ' LEU . 47.4 t90 -147.14 136.41 22.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.873 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -125.73 133.22 24.69 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.382 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.96 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 5.6 Cg_exo -74.81 148.68 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.596 2.197 . . . . 0.0 111.62 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.572 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 73.5 mt-10 -65.54 130.86 44.8 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.102 0.477 . . . . 0.0 110.829 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.03 2.19 62.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.129 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.96 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 4.3 mptt -113.28 148.89 34.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.691 0.281 . . . . 0.0 110.337 179.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -98.06 5.86 48.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.603 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -141.34 152.83 44.74 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.158 0.504 . . . . 0.0 111.844 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -82.98 122.87 28.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.902 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -90.87 -18.61 24.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.31 0.576 . . . . 0.0 110.532 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.599 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 18.1 mm -112.49 117.84 56.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.392 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 25.9 t -148.06 101.46 3.29 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.449 ' CD2' HG21 ' B' ' 43' ' ' ILE . 48.8 m-70 -125.11 138.04 54.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.986 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.5 ' O ' HG12 ' B' ' 50' ' ' ILE . 67.5 mmm -87.94 143.54 27.05 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD21 ' B' ' 100' ' ' LEU . 21.5 m-85 -58.73 -21.86 56.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.907 0.384 . . . . 0.0 110.516 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.91 -13.1 60.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.679 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.625 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.4 -10.67 16.83 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.321 0.582 . . . . 0.0 109.586 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.602 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.6 mm -89.37 127.21 42.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.529 ' HZ3' ' CG ' ' A' ' 410' ' ' ASP . 21.9 tttp -84.8 -44.53 13.19 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.447 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -161.29 -178.03 6.42 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.052 -0.976 . . . . 0.0 108.731 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -144.49 142.15 30.06 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.259 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.106 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 28.6 mttp -108.61 155.26 20.88 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.683 HG22 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.51 127.65 62.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 176.447 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' SER . . . . . 0.404 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -90.64 116.91 67.46 Favored Pre-proline 0 C--O 1.249 1.029 0 C-N-CA 120.016 -0.674 . . . . 0.0 109.432 -179.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 73.6 Cg_endo -69.36 173.37 10.72 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 125.24 3.96 . . . . 0.0 113.767 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -58.38 160.33 5.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.647 -1.16 . . . . 0.0 110.092 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.2 7.87 Favored Glycine 0 C--N 1.315 -0.605 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.787 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 6.7 mttm -88.66 152.92 21.51 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.4 -9.11 55.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.335 0.588 . . . . 0.0 110.456 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.817 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.65 141.98 37.02 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.689 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.686 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -83.85 130.19 36.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.472 HE21 ' HB2' ' B' ' 64' ' ' GLN . 3.6 mt-30 -132.05 162.78 29.94 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 118.805 -1.158 . . . . 0.0 113.851 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.413 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 2.0 tp -139.91 153.56 47.0 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.851 -1.522 . . . . 0.0 107.272 177.06 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.106 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.97 138.21 25.35 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.311 178.869 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.768 HD12 HD11 ' B' ' 31' ' ' ILE . 71.8 mt -94.17 104.94 16.94 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.501 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.692 ' HA ' HG23 ' B' ' 74' ' ' THR . 10.7 t -89.09 109.07 19.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.488 HD13 ' OD1' ' B' ' 73' ' ' ASP . 2.3 mt -93.82 157.26 16.22 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.985 -177.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.625 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -81.31 1.04 34.39 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.232 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -16.17 59.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.548 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 104.25 7.59 40.15 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.939 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . 0.488 ' OD1' HD13 ' B' ' 69' ' ' LEU . 8.7 p-10 -126.37 170.42 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.206 0.527 . . . . 0.0 111.859 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.692 HG23 ' HA ' ' B' ' 68' ' ' VAL . 8.8 p -137.57 131.93 32.39 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.763 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 9.6 m -103.98 112.56 25.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.73 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 1.007 ' HB2' ' HG2' ' A' ' 395' ' ' GLU . 4.8 m-20 -84.51 153.87 23.04 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.628 0.728 . . . . 0.0 112.164 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.559 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 36.7 m-85 -133.62 111.86 10.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.573 178.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.558 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.7 t60 -86.59 98.97 11.38 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.701 -177.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.852 ' HB3' ' HB3' ' B' ' 85' ' ' ALA . 41.8 m-85 -77.06 95.57 4.23 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.42 4.97 44.2 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.558 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -80.3 91.35 5.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.125 0.488 . . . . 0.0 110.297 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.18 -42.1 4.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.325 -0.852 . . . . 0.0 113.173 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -59.75 4.72 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 18.1 p -127.62 8.75 6.43 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.852 ' HB3' ' HB3' ' B' ' 79' ' ' PHE . . . -43.75 -47.93 7.99 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -178.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.436 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.11 -52.03 65.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.845 0.355 . . . . 0.0 111.016 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.505 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 6.4 mptt -67.67 -35.09 78.21 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.036 0.446 . . . . 0.0 109.817 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.662 ' O ' HG21 ' B' ' 92' ' ' VAL . 12.0 mt-10 -64.75 -44.79 88.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.686 ' HD3' HG23 ' B' ' 63' ' ' ILE . 28.3 ttp180 -54.55 -47.64 72.97 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . 0.627 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -61.94 -44.86 95.9 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.293 179.687 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.39 -41.43 80.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 117.79 0.268 . . . . 0.0 111.406 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.886 HG11 HD13 ' B' ' 26' ' ' LEU . 41.1 t -62.42 -42.23 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 177.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.683 ' HG3' HG22 ' B' ' 55' ' ' ILE . 1.1 tmmt? -59.43 -56.97 15.26 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.436 177.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.92 -52.99 58.83 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.148 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.727 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.9 tp -61.19 -42.77 99.17 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.038 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.455 HD12 HG12 ' B' ' 92' ' ' VAL . 21.2 mt -68.01 -43.89 77.8 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.18 -24.1 66.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.066 0.936 . . . . 0.0 109.381 178.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -84.9 -49.98 7.91 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.326 -1.306 . . . . 0.0 110.74 178.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.727 HD12 ' HG ' ' B' ' 95' ' ' LEU . 11.9 mt -77.09 -47.28 20.92 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 113.574 -1.648 . . . . 0.0 115.257 -176.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.718 HD21 ' HB3' ' B' ' 47' ' ' TYR . 33.0 mt -50.19 -54.8 30.04 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -176.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 25.9 Cg_endo -60.64 -16.49 43.44 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.091 1.861 . . . . 0.0 113.337 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -87.77 -8.73 55.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -119.28 -35.44 3.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.269 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' B' ' 100' ' ' LEU . 62.1 pttt -80.93 114.87 20.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.383 0.611 . . . . 0.0 109.974 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . 0.427 ' HA ' ' HD2' ' B' ' 105' ' ' ARG . 8.9 tpt85 -142.43 93.75 2.57 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.46 ' CE ' ' HA ' ' A' ' 410' ' ' ASP . 3.0 pptp? -92.4 -166.62 1.58 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.244 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -78.95 50.07 0.99 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 14.4 t30 . . . . . 0 C--O 1.243 0.753 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.335 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.425 ' HB2' ' H ' ' A' ' 393' ' ' VAL . 7.2 p90 . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . 0.425 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 7.5 p -63.12 135.29 27.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 179.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 85.37 -68.05 3.51 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.568 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.514 ' HG2' ' CG ' ' B' ' 76' ' ' ASN . 9.8 tp10 -119.49 127.99 53.56 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.231 0.539 . . . . 0.0 110.853 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -136.65 30.62 2.84 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.241 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.741 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 22.9 t70 -50.77 -37.51 42.57 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.06 -178.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.739 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 7.4 tt0 165.9 -95.95 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 177.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.996 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.3 tt0 -114.09 95.73 5.45 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.304 -177.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.628 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 13.1 p-10 -136.59 93.21 2.84 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.753 0.787 . . . . 0.0 111.803 -178.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.543 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.2 p-10 -139.29 -44.72 0.46 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 16.2 p30 -74.41 12.8 0.69 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.718 0.77 . . . . 0.0 110.103 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.711 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -55.29 121.54 9.13 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.673 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -97.72 133.68 41.92 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.426 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.628 ' HG3' ' HB2' ' A' ' 409' ' ' ASP . 5.6 mm-40 -86.29 171.51 11.17 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.215 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -168.44 -23.91 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.747 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . 0.576 ' HB3' ' CB ' ' B' ' 52' ' ' CYS . 17.1 t0 -93.45 -7.07 45.52 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 83.92 121.88 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 113.293 -1.776 . . . . 0.0 113.626 175.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.628 ' HB2' ' HG3' ' A' ' 405' ' ' GLU . 9.4 t0 -99.71 49.27 0.93 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.006 -1.452 . . . . 0.0 111.289 -178.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.246 0.878 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.735 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.486 ' H ' ' CD ' ' B' ' 29' ' ' GLU . 17.7 tpt . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.35 30.72 19.97 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.382 0.611 . . . . 0.0 110.079 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -111.51 -60.27 1.87 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.548 -179.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' SER . . . . . 0.718 ' HB2' ' HG3' ' B' ' 29' ' ' GLU . 7.0 m -80.23 101.51 8.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.343 0.592 . . . . 0.0 110.151 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' SER . . . . . 0.439 ' HB3' ' CZ ' ' B' ' 30' ' ' ARG . 70.5 m -151.89 27.05 0.63 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.516 -179.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.33 6.16 7.73 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.921 0.867 . . . . 0.0 109.851 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.47 ' HG2' ' N ' ' B' ' 8' ' ' VAL . 0.0 OUTLIER -123.26 149.39 44.82 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 114.347 -1.297 . . . . 0.0 109.513 -179.034 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.47 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 41.8 t -123.58 117.75 52.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.826 0.346 . . . . 0.0 110.289 179.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 82.4 mt -87.16 -31.93 20.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.711 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 5.9 tp -138.53 134.5 33.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 68.3 mt -117.61 124.18 72.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.733 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.2 t -115.65 149.96 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.652 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.632 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -111.17 179.3 4.08 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.43 -178.943 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.538 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 1.3 mptp? 18.55 70.63 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 O-C-N 124.978 1.424 . . . . 0.0 113.939 -179.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.676 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.0 t -123.39 120.35 59.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.151 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.548 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 3.2 mtm180 -92.38 142.39 27.49 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.198 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.57 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.33 105.38 5.21 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.17 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 mptt 71.91 49.24 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.887 0.742 . . . . 0.0 110.818 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.741 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 7.9 mptt 70.6 27.66 3.72 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.647 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.8 pt20 -145.98 132.46 19.73 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.911 -0.493 . . . . 0.0 110.649 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -80.06 153.17 28.95 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.967 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.475 ' HA2' ' H ' ' B' ' 36' ' ' GLU . . . -178.09 -162.67 28.35 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.239 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.99 137.44 54.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.062 0.458 . . . . 0.0 109.863 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.87 HD11 ' HB2' ' B' ' 33' ' ' TRP . 6.3 tp -98.01 141.51 30.88 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.24 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -136.57 113.7 10.61 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.782 HD12 HG12 ' B' ' 92' ' ' VAL . 14.7 mt -90.53 130.99 36.52 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.34 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 15.0 mtt -112.13 159.89 18.09 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.03 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.3 -40.31 5.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.718 ' HG3' ' HB2' ' B' ' 4' ' ' SER . 20.7 mt-10 -119.53 -4.44 10.34 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.439 ' CZ ' ' HB3' ' B' ' 5' ' ' SER . 27.2 ptt180 -151.72 158.63 43.64 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.534 -177.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 1.009 HD12 HD12 ' B' ' 67' ' ' LEU . 1.7 tt -107.83 120.49 59.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -120.26 146.85 45.67 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.001 0.429 . . . . 0.0 110.694 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.87 ' HB2' HD11 ' B' ' 24' ' ' LEU . 24.1 t90 -146.83 140.07 25.48 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.508 ' HB3' ' HA ' ' B' ' 41' ' ' PHE . . . -133.93 141.05 38.3 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.798 -179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.454 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 14.3 Cg_exo -65.94 141.51 64.96 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.383 2.055 . . . . 0.0 110.522 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.475 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 4.4 mt-10 -64.57 116.0 5.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.318 0.58 . . . . 0.0 109.589 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 109.61 3.29 30.62 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.781 ' HZ2' ' HA ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -107.14 148.5 28.75 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.403 0.62 . . . . 0.0 111.306 179.467 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -93.32 -22.35 19.02 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.473 -1.24 . . . . 0.0 111.828 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.1 133.77 55.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.73 0.3 . . . . 0.0 111.174 -178.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.508 ' HA ' ' HB3' ' B' ' 34' ' ' ALA . 75.2 m-85 -68.66 120.98 15.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' THR . . . . . 0.433 ' OG1' ' HD3' ' B' ' 35' ' ' PRO . 0.8 OUTLIER -79.91 -39.33 30.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.023 0.44 . . . . 0.0 110.638 -179.799 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.615 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 17.6 mm -93.08 119.12 40.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.954 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -147.95 101.22 3.28 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.445 ' CD2' HG22 ' B' ' 43' ' ' ILE . 52.3 m-70 -132.05 143.32 49.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.935 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.458 ' HE3' ' HB3' ' B' ' 46' ' ' MET . 5.9 mtp -91.36 145.16 24.87 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.765 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.51 -21.69 39.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.045 0.45 . . . . 0.0 110.413 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.65 -10.7 59.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.992 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.612 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.01 -4.59 17.69 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.315 0.578 . . . . 0.0 109.831 179.624 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.728 ' HB ' HD21 ' B' ' 100' ' ' LEU . 2.7 mm -90.3 132.84 33.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.528 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 17.7 ttpt -88.86 -41.84 12.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.274 0.559 . . . . 0.0 109.713 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.725 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 24.3 p -162.35 -178.0 6.03 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.403 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -146.73 139.24 25.01 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.741 0.305 . . . . 0.0 110.853 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.042 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 19.0 mttp -109.58 156.5 20.1 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.538 HG22 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.37 128.09 63.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 176.048 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' SER . . . . . 0.406 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -89.03 118.92 69.68 Favored Pre-proline 0 C--O 1.249 1.036 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.32 173.18 13.49 Favored 'Trans proline' 0 C--O 1.234 0.316 1 C-N-CA 125.311 4.008 . . . . 0.0 114.559 -177.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -60.21 160.98 7.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.201 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.31 -29.14 7.82 Favored Glycine 0 C--N 1.316 -0.53 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.996 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 10.0 mttp -90.7 154.0 19.87 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 2.76 8.49 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.236 0.541 . . . . 0.0 110.502 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.23 148.04 32.08 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.526 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.64 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -96.86 136.54 27.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.406 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 10.5 mt-30 -138.7 163.24 32.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.57 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.6 153.59 47.4 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 113.812 -1.54 . . . . 0.0 106.862 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.042 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -145.99 134.49 22.03 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 119.302 0.955 . . . . 0.0 111.266 178.845 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 1.009 HD12 HD12 ' B' ' 31' ' ' ILE . 26.0 mt -94.15 104.15 16.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.768 178.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.725 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -88.62 103.73 14.1 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.578 HD21 HD11 ' B' ' 50' ' ' ILE . 2.4 mt -89.25 157.86 18.07 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.05 -177.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.612 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.3 0.27 37.77 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.018 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.79 -10.16 59.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.15 11.57 54.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.002 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -126.41 154.72 43.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.605 HG22 ' HA ' ' B' ' 68' ' ' VAL . 13.7 p -124.11 131.01 53.5 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.588 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 1.4 m -103.64 98.63 8.48 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.518 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 4.8 m-20 -85.74 122.36 29.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.404 0.621 . . . . 0.0 111.885 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.612 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 63.0 m-85 -103.81 113.37 26.85 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.008 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.676 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.9 t60 -86.59 100.0 12.11 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.041 -178.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.723 ' HZ ' HG21 ' B' ' 92' ' ' VAL . 54.8 m-85 -76.84 88.18 3.44 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.09 13.09 35.69 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.538 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.8 t-20 -83.22 92.94 7.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.318 0.58 . . . . 0.0 109.933 179.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.06 -34.9 0.79 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.84 -59.57 3.42 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -178.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.524 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -127.36 11.6 6.92 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -176.151 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.656 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -44.9 -47.87 11.24 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.96 -52.1 65.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.887 0.375 . . . . 0.0 110.817 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.524 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.8 mttt -66.6 -34.11 77.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.922 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.602 ' O ' HG22 ' B' ' 92' ' ' VAL . 12.1 mt-10 -65.71 -44.44 86.08 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.64 ' HD3' HG23 ' B' ' 63' ' ' ILE . 26.2 ttp180 -56.29 -47.86 77.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . 0.515 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.43 -44.38 96.55 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 113.865 -1.516 . . . . 0.0 112.381 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.14 -44.46 79.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.767 0.258 . . . . 0.0 111.312 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.782 HG12 HD12 ' B' ' 26' ' ' LEU . 48.9 t -60.33 -44.09 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.538 ' HG3' HG22 ' B' ' 55' ' ' ILE . 1.1 tmmt? -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.724 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -55.53 25.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.895 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.729 ' HG ' HD13 ' B' ' 99' ' ' LEU . 12.4 tp -63.26 -32.56 74.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.139 -179.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.516 HD11 HG13 ' B' ' 92' ' ' VAL . 20.9 mt -76.36 -39.26 54.32 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -66.08 -18.58 65.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.289 1.042 . . . . 0.0 108.621 178.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -87.88 -48.4 7.84 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.521 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.729 HD13 ' HG ' ' B' ' 95' ' ' LEU . 16.3 mt -82.8 -37.32 24.68 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 -176.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.765 HD23 ' HB3' ' B' ' 47' ' ' TYR . 66.4 mt -63.48 -58.44 15.48 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.684 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 37.7 Cg_exo -58.57 -23.49 65.23 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.245 1.964 . . . . 0.0 113.499 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.43 ' HE2' ' HB2' ' B' ' 102' ' ' LYS . 2.3 ptmm? -88.15 1.37 54.52 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.468 ' HD1' ' O ' ' B' ' 99' ' ' LEU . 21.6 m-85 -124.26 -35.66 2.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.705 0.288 . . . . 0.0 111.132 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.535 ' HZ1' ' CG ' ' A' ' 407' ' ' ASP . 64.6 pttt -81.8 161.09 23.37 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' B' ' 108' ' ' ASN . 0.3 OUTLIER -62.75 -50.98 68.93 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.769 ' HA ' ' HE3' ' B' ' 106' ' ' LYS . 0.1 OUTLIER 179.92 -68.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.59 178.739 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -120.62 13.29 11.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.978 0.894 . . . . 0.0 108.812 178.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.447 ' O ' ' HB2' ' B' ' 105' ' ' ARG . 4.7 p-10 . . . . . 0 C--O 1.253 1.288 0 CA-C-N 113.912 -1.495 . . . . 0.0 108.212 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 22.5 p90 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 42.4 t -64.64 112.65 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 179.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 101.53 -80.81 0.42 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . 0.6 ' CD ' ' HZ1' ' B' ' 18' ' ' LYS . 6.8 tp10 -99.11 131.66 44.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.144 0.497 . . . . 0.0 109.776 179.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 398' ' ' GLU . 4.2 t70 -136.67 31.0 2.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.797 -179.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.429 ' O ' ' CB ' ' A' ' 398' ' ' GLU . 0.4 OUTLIER -64.51 16.61 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -178.837 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.542 ' H ' ' C ' ' A' ' 396' ' ' ASP . 8.4 tt0 108.15 -68.9 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.655 1.582 . . . . 0.0 113.186 175.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.946 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.7 tt0 -148.72 93.09 2.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.92 0.39 . . . . 0.0 110.916 -177.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.59 ' HB2' ' CE2' ' A' ' 403' ' ' PHE . 11.8 p-10 -134.0 94.46 3.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.76 0.79 . . . . 0.0 111.857 -178.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.524 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.42 -46.98 0.46 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -73.31 12.09 0.64 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.377 0.608 . . . . 0.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.643 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -53.29 115.96 2.17 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.596 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.73 136.62 37.46 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 1.031 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -148.98 -178.52 6.41 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.576 1.324 . . . . 0.0 114.576 -176.733 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . 0.466 ' C ' ' H ' ' A' ' 408' ' ' GLU . 24.7 p-10 -154.77 62.4 0.66 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 111.977 -2.374 . . . . 0.0 105.183 177.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . 0.574 ' HA ' ' SG ' ' B' ' 52' ' ' CYS . 0.1 OUTLIER -59.21 14.11 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -176.429 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.466 ' H ' ' C ' ' A' ' 406' ' ' ASN . 1.6 mt-10 -63.27 -76.09 0.07 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.411 ' HA ' ' O ' ' B' ' 51' ' ' LYS . 25.3 t0 -175.78 72.61 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.862 178.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.709 ' HB3' ' HA ' ' B' ' 52' ' ' CYS . 16.1 t70 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.057 -179.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.481 1.091 0 CA-C-O 120.67 0.271 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.02 100.07 2.0 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.4 44.61 7.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.708 0.766 . . . . 0.0 109.854 -179.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.29 15.1 23.85 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.795 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' SER . . . . . 0.454 ' HA ' ' CD ' ' B' ' 29' ' ' GLU . 16.2 m 67.76 19.49 9.64 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.301 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.531 ' OE2' ' HA ' ' B' ' 6' ' ' GLU . 2.7 mm-40 -146.52 19.87 1.34 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.598 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.638 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.4 OUTLIER -81.76 101.11 9.91 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.472 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.54 HG22 ' HE1' ' B' ' 27' ' ' MET . 90.9 t -81.82 117.45 27.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.371 0.605 . . . . 0.0 111.477 -177.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.47 ' HB2' HD22 ' B' ' 95' ' ' LEU . 23.4 mt -97.79 -31.61 12.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.34 179.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.3 tp -132.97 137.8 46.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.8 mt -122.34 121.59 64.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.5 t -110.6 148.67 13.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.136 -179.373 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.565 ' HD3' ' N ' ' B' ' 13' ' ' LYS . 0.1 OUTLIER -108.3 174.09 6.03 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.673 -178.78 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 18.0 70.05 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 O-C-N 125.084 1.49 . . . . 0.0 114.27 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.548 HG21 ' O ' ' B' ' 13' ' ' LYS . 39.1 t -116.21 120.98 66.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.604 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 31.9 mtp180 -96.7 119.85 35.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.154 0.502 . . . . 0.0 110.953 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' B' ' 76' ' ' ASN . 10.7 tm0? -109.98 119.84 40.58 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.6 ' HZ1' ' CD ' ' A' ' 395' ' ' GLU . 0.0 OUTLIER 65.56 33.52 8.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -178.262 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.35 18.65 7.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.332 -1.304 . . . . 0.0 111.552 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.569 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tp-100 -110.12 119.1 38.21 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.33 144.4 56.59 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.746 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . -178.92 -165.94 34.12 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.409 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.59 136.81 53.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.071 0.462 . . . . 0.0 109.897 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.868 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.81 142.22 29.84 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.4 -177.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -135.03 124.16 24.38 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.895 HD13 HG13 ' B' ' 92' ' ' VAL . 19.3 mt -105.3 121.11 43.19 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.643 -178.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.638 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.3 mpt? -97.88 159.13 15.13 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.79 -21.54 56.27 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.454 ' CD ' ' HA ' ' B' ' 5' ' ' SER . 3.9 mp0 -116.87 -16.85 10.55 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.503 HH21 ' CD ' ' B' ' 6' ' ' GLU . 12.8 ptt180 -154.84 164.73 38.4 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.374 -176.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.943 HD12 HD13 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -114.32 122.55 68.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.233 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.542 ' HB1' ' HE3' ' B' ' 27' ' ' MET . . . -125.45 152.55 44.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.033 0.444 . . . . 0.0 110.512 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.868 ' HB2' HD12 ' B' ' 24' ' ' LEU . 21.9 t90 -146.87 136.81 23.3 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.443 ' HB1' ' CD1' ' B' ' 41' ' ' PHE . . . -122.38 135.35 25.46 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.185 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 1.094 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 4.8 Cg_exo -72.08 150.09 53.57 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.54 2.16 . . . . 0.0 111.803 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.746 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.1 mt-10 -63.66 124.41 21.36 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.928 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.59 6.47 62.43 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 1.094 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 10.0 mptt -113.32 149.71 33.57 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -97.06 -1.39 45.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.888 -178.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -132.63 151.07 52.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.169 0.509 . . . . 0.0 112.055 -178.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.443 ' CD1' ' HB1' ' B' ' 34' ' ' ALA . 44.1 m-85 -83.88 121.26 27.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.678 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.1 p -87.53 -21.85 25.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.208 0.528 . . . . 0.0 110.487 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.577 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 11.5 mm -102.39 122.98 55.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.23 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.3 t -147.68 101.56 3.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.183 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.505 ' CD2' HG21 ' B' ' 43' ' ' ILE . 51.0 m-70 -133.99 139.44 46.06 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.471 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.4 mtp -96.94 148.68 22.71 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.671 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.4 m-85 -58.18 -23.2 54.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.853 0.359 . . . . 0.0 111.287 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.99 -25.28 62.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.053 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.62 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -97.15 -4.76 38.66 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.823 0.344 . . . . 0.0 110.833 -179.614 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.56 HD11 HD21 ' B' ' 69' ' ' LEU . 4.1 mm -83.45 131.48 33.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.42 ' HB2' ' N ' ' B' ' 70' ' ' HIS . 13.7 tttm -91.94 -37.19 13.01 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.73 0.3 . . . . 0.0 110.352 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.709 ' HA ' ' HB3' ' A' ' 410' ' ' ASP . 1.6 p -169.39 179.97 3.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -139.83 143.83 37.0 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.271 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.15 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 16.9 mttm -115.3 150.1 36.78 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.506 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.7 OUTLIER -130.57 129.25 64.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.653 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' SER . . . . . 0.472 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -91.34 121.15 67.99 Favored Pre-proline 0 C--O 1.249 1.028 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.283 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -72.56 173.44 13.27 Favored 'Trans proline' 0 C--O 1.234 0.318 1 C-N-CA 125.586 4.191 . . . . 0.0 114.733 -177.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -58.67 160.64 5.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.407 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.92 -29.01 8.03 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 -178.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.946 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.9 mttp -89.81 154.62 19.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.3 -11.85 61.18 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.216 0.532 . . . . 0.0 110.299 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.626 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.15 140.84 40.04 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.769 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.565 HG22 ' HD3' ' B' ' 89' ' ' ARG . 3.3 mp -85.21 140.3 16.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . 0.472 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 18.8 mt-30 -139.94 163.18 33.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.455 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.3 tp -142.54 153.54 43.67 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.339 176.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.15 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 137.22 23.73 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 119.241 0.928 . . . . 0.0 110.939 178.281 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.943 HD13 HD12 ' B' ' 31' ' ' ILE . 96.4 mt -94.14 104.09 16.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.869 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.577 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 5.7 t -88.59 110.78 21.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.56 HD21 HD11 ' B' ' 50' ' ' ILE . 4.4 mt -97.57 155.9 16.76 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.62 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.6 OUTLIER -81.67 2.95 27.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.013 178.218 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.85 -5.83 59.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.157 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.31 16.14 53.94 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.547 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -126.12 154.3 43.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.759 0.314 . . . . 0.0 110.775 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.485 HG23 ' HA ' ' B' ' 68' ' ' VAL . 17.0 p -130.23 130.71 44.95 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.583 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.2 m -106.56 98.98 8.58 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.62 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.48 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 5.3 m-20 -82.41 147.09 28.97 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.848 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.518 ' HZ ' HG23 ' B' ' 43' ' ' ILE . 59.2 m-85 -131.24 112.71 13.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.834 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.604 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.7 t-160 -87.03 99.91 12.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.285 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.752 ' HB3' ' HB2' ' B' ' 85' ' ' ALA . 43.1 m-85 -75.07 100.02 4.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.53 11.4 28.76 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.438 ' O ' ' HB1' ' B' ' 85' ' ' ALA . 1.7 t-20 -85.66 91.66 8.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.243 0.544 . . . . 0.0 109.733 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.58 -34.23 2.07 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.23 -57.66 7.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.499 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.48 8.72 6.5 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -176.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.752 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -43.93 -47.27 8.43 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -178.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 t -59.84 -54.18 38.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.915 0.388 . . . . 0.0 110.747 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.499 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -65.55 -33.36 75.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.959 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.663 ' O ' HG22 ' B' ' 92' ' ' VAL . 12.7 mt-10 -66.09 -45.39 81.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.565 ' HD3' HG22 ' B' ' 63' ' ' ILE . 17.6 ttp180 -56.06 -47.91 77.04 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . 0.674 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -61.22 -44.19 97.67 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 113.619 -1.628 . . . . 0.0 111.96 179.797 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.61 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.704 0.229 . . . . 0.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.895 HG13 HD13 ' B' ' 26' ' ' LEU . 45.4 t -62.81 -44.69 99.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.674 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.8 OUTLIER -58.82 -52.68 64.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.793 178.254 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . 0.433 ' HA ' ' HG2' ' B' ' 97' ' ' GLN . 1.2 m-20 -58.67 -53.29 59.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.81 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.719 ' HG ' HD13 ' B' ' 99' ' ' LEU . 13.2 tp -60.64 -38.58 85.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 25.8 mt -70.15 -45.44 66.76 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . 0.433 ' HG2' ' HA ' ' B' ' 94' ' ' ASP . 19.7 pt20 -64.85 -18.07 64.83 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.218 1.009 . . . . 0.0 109.195 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -85.91 -49.78 7.61 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.928 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.719 HD13 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -78.96 -47.25 16.68 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.473 -1.694 . . . . 0.0 115.146 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.671 HD23 ' HB3' ' B' ' 47' ' ' TYR . 34.9 mt -52.23 -56.3 23.43 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 32.2 Cg_exo -61.59 -13.43 29.72 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.398 2.065 . . . . 0.0 113.417 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 7.9 mtmm -85.48 -23.17 27.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.982 0.42 . . . . 0.0 110.285 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -120.08 21.11 11.94 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.644 ' HA ' ' HE3' ' B' ' 104' ' ' LYS . 0.4 OUTLIER -57.95 101.15 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.019 -0.991 . . . . 0.0 112.285 -178.277 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -146.07 -144.81 0.16 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.231 -0.895 . . . . 0.0 108.869 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -144.13 97.51 3.06 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . 73.84 -175.33 0.15 Allowed 'General case' 0 C--O 1.235 0.33 0 O-C-N 124.409 1.068 . . . . 0.0 110.999 -179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.605 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 392' ' ' TYR . . . . . 0.849 ' HE2' ' HA ' ' A' ' 399' ' ' GLU . 7.5 p90 . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 393' ' ' VAL . . . . . 0.449 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 24.7 t -61.74 119.75 6.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.646 0.26 . . . . 0.0 110.488 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 96.03 -82.22 0.8 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.785 -0.721 . . . . 0.0 111.62 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -108.65 144.1 36.85 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -129.71 30.08 4.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.485 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.556 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 1.7 t70 -66.81 -31.88 72.8 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 398' ' ' GLU . . . . . 0.576 ' HB3' ' HE3' ' B' ' 62' ' ' LYS . 1.1 tm-20 167.53 -60.86 0.01 OUTLIER 'General case' 0 C--O 1.232 0.134 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.074 177.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 399' ' ' GLU . . . . . 0.88 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 63.0 tt0 -168.62 100.51 0.4 Allowed 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 400' ' ' ASP . . . . . 0.628 ' HB3' ' CD1' ' A' ' 403' ' ' PHE . 0.8 OUTLIER -133.67 90.74 2.75 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -175.513 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 401' ' ' ASP . . . . . 0.566 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -138.99 -48.41 0.5 Allowed 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -72.06 13.59 0.29 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.929 0.871 . . . . 0.0 110.538 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 403' ' ' PHE . . . . . 0.962 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -61.68 119.39 8.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.192 -1.367 . . . . 0.0 111.025 179.553 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 404' ' ' ASN . . . . . 0.401 ' O ' ' HA ' ' B' ' 54' ' ' LYS . 41.7 m-80 -108.53 133.34 52.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.775 -179.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 405' ' ' GLU . . . . . 0.535 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 1.8 pt-20 -114.85 -112.94 0.34 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.514 0.197 . . . . 0.0 110.91 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.06 -172.32 3.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.938 0.399 . . . . 0.0 110.911 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -112.12 -2.96 14.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.591 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . 0.403 ' H ' ' HG3' ' A' ' 408' ' ' GLU . 0.0 OUTLIER -85.07 163.14 19.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.106 0.479 . . . . 0.0 111.826 -178.423 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 409' ' ' ASP . . . . . 0.459 ' CG ' HH12 ' B' ' 105' ' ' ARG . 29.5 p-10 -95.16 -42.88 8.35 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 410' ' ' ASP . . . . . 0.691 ' HA ' ' NZ ' ' B' ' 104' ' ' LYS . 7.5 t70 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.112 -0.947 . . . . 0.0 111.423 177.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 43.6 ttm . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.69 23.92 0.18 Allowed 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 6.2 m 63.63 61.91 0.97 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.388 0.613 . . . . 0.0 111.526 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.01 -50.16 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.981 179.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 63.0 m -156.91 78.89 0.91 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' GLU . . . . . 0.818 ' HB2' ' HB3' ' B' ' 27' ' ' MET . 2.2 mm-40 -78.18 161.33 27.42 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.18 -176.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' B' ' 27' ' ' MET . 1.9 mp0 -63.9 111.28 2.41 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.378 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 63.9 t -82.48 104.24 10.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.7 mt -82.78 -31.11 28.42 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.515 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.6 tp -132.53 123.03 25.74 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.1 mt -109.6 120.64 61.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . 0.735 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.0 t -112.91 149.62 15.32 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' LYS . . . . . 0.586 ' O ' HG22 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -109.48 -179.94 3.97 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.984 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.431 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.8 mttp 17.95 76.31 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 125.393 1.683 . . . . 0.0 113.533 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.586 HG22 ' O ' ' B' ' 13' ' ' LYS . 39.6 t -127.9 125.0 64.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.615 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 1.4 mtt-85 -99.04 146.11 26.39 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.388 0.614 . . . . 0.0 112.201 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . 0.538 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 6.4 tp-100 -119.75 102.71 8.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 1.1 mptp? 55.61 56.73 5.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.104 -178.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.556 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 3.2 mptm? 76.33 9.75 3.1 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 178.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' GLN . . . . . 0.674 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 5.9 pt20 -119.56 119.65 34.41 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.173 0.897 . . . . 0.0 110.755 178.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.538 ' OD2' ' HD3' ' B' ' 16' ' ' ARG . 2.1 m-20 -72.42 149.68 44.04 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.609 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -175.98 -161.31 24.97 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.744 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.36 139.45 53.66 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.859 HD13 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.75 137.28 39.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.743 -178.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -133.46 108.72 8.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.826 0.346 . . . . 0.0 110.412 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . 0.932 HD13 HG11 ' B' ' 92' ' ' VAL . 10.7 mt -84.59 121.42 27.6 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.905 0.383 . . . . 0.0 110.332 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' MET . . . . . 0.818 ' HB3' ' HB2' ' B' ' 6' ' ' GLU . 0.5 OUTLIER -99.38 166.32 11.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.486 -178.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.2 -52.99 8.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.446 ' CD ' HH21 ' B' ' 30' ' ' ARG . 1.5 mp0 -114.2 7.03 16.46 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.493 ' NE ' ' HG3' ' B' ' 6' ' ' GLU . 10.1 ptp180 -158.94 157.86 32.2 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.513 -0.875 . . . . 0.0 112.682 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' ILE . . . . . 0.873 HD13 HD13 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -103.68 119.03 51.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.345 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.516 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -115.31 147.07 40.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.911 0.386 . . . . 0.0 110.801 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' TRP . . . . . 0.859 ' HB2' HD13 ' B' ' 24' ' ' LEU . 35.9 t90 -147.18 145.46 29.51 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 1.038 ' HB2' ' HG3' ' B' ' 38' ' ' LYS . . . -145.44 133.23 10.45 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.746 -0.206 . . . . 0.0 111.183 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . 0.609 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 69.7 Cg_endo -70.68 132.77 22.48 Favored 'Trans proline' 0 N--CA 1.476 0.474 0 C-N-CA 123.457 2.771 . . . . 0.0 111.79 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.494 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 0.0 OUTLIER -50.3 132.17 24.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.194 -178.453 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.73 11.03 39.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -177.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 1.038 ' HG3' ' HB2' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -99.62 166.7 11.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.585 -0.807 . . . . 0.0 111.953 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -124.22 -4.98 7.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.444 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -146.2 164.09 33.35 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.259 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.673 ' HA ' ' HB1' ' B' ' 34' ' ' ALA . 36.2 m-85 -88.22 130.86 34.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.229 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.3 p -94.33 -25.92 16.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.56 . . . . 0.0 110.32 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.759 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -106.04 120.68 57.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.302 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 45.8 t -147.91 101.43 3.3 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' HIS . . . . . 0.415 ' CD2' HG22 ' B' ' 43' ' ' ILE . 79.9 m-70 -123.33 137.96 54.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' MET . . . . . 0.47 ' O ' HG12 ' B' ' 50' ' ' ILE . 70.9 mmm -85.9 140.91 29.96 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD21 ' B' ' 100' ' ' LEU . 22.9 m-85 -57.66 -22.85 48.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.969 0.414 . . . . 0.0 110.501 179.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.77 -22.31 60.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.807 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.648 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -96.32 -6.82 36.87 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.11 0.481 . . . . 0.0 110.067 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.619 ' HB ' HD22 ' B' ' 100' ' ' LEU . 4.4 mm -87.28 118.22 32.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.613 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 0.6 OUTLIER -79.39 -30.88 42.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.226 0.536 . . . . 0.0 109.615 -178.655 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.613 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 9.4 p -176.1 173.69 2.17 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.751 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 18.8 pm0 -132.42 137.91 47.46 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.199 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 1.105 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -104.75 148.97 26.02 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . 0.497 HG13 ' O ' ' B' ' 55' ' ' ILE . 0.8 OUTLIER -127.25 127.04 68.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 175.998 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -88.3 116.66 66.88 Favored Pre-proline 0 C--O 1.252 1.188 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.83 173.3 11.23 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 125.211 3.941 . . . . 0.0 114.484 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -60.73 160.33 9.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.47 -29.06 8.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.331 -1.507 . . . . 0.0 109.331 -177.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.88 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.5 mttp -88.45 152.26 22.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 176.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.4 -8.98 51.42 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 121.127 0.489 . . . . 0.0 110.942 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.576 ' HE3' ' HB3' ' A' ' 398' ' ' GLU . 0.0 OUTLIER -141.74 140.8 33.2 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.597 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' ILE . . . . . 0.595 HG21 ' HD3' ' B' ' 89' ' ' ARG . 3.4 mp -86.31 135.49 24.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 178.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -139.5 163.31 32.88 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 118.897 -1.121 . . . . 0.0 113.992 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 1.7 tp -138.88 153.07 48.26 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.054 -1.43 . . . . 0.0 107.522 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 1.105 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 142.96 28.3 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 119.25 0.932 . . . . 0.0 111.183 178.201 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.873 HD13 HD13 ' B' ' 31' ' ' ILE . 95.7 mt -95.29 103.13 14.98 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.925 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . 0.718 ' HA ' HG23 ' B' ' 74' ' ' THR . 12.3 t -87.12 115.94 28.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.522 HD22 HD11 ' B' ' 50' ' ' ILE . 4.1 mt -101.13 154.87 18.36 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.11 0.481 . . . . 0.0 111.952 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.648 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.43 -1.95 36.05 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.384 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.99 -15.3 61.1 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.63 178.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 102.8 7.45 44.61 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.929 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' ASP . . . . . 0.477 ' OD2' HD12 ' B' ' 69' ' ' LEU . 4.8 p-10 -126.44 167.71 15.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.117 0.484 . . . . 0.0 111.572 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' THR . . . . . 0.718 HG23 ' HA ' ' B' ' 68' ' ' VAL . 33.2 p -136.63 131.45 33.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.752 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' THR . . . . . 0.562 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.2 m -100.57 99.33 9.89 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 178.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' ASN . . . . . 0.401 HD21 ' CG ' ' A' ' 400' ' ' ASP . 2.5 m-20 -82.46 148.17 28.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.238 0.542 . . . . 0.0 111.485 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' PHE . . . . . 0.759 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 54.0 m-85 -131.59 113.99 14.3 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.767 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.557 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.8 t-160 -87.05 105.3 17.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.447 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.724 ' HB3' ' HB2' ' B' ' 85' ' ' ALA . 29.0 m-85 -76.41 97.48 4.29 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -95.18 7.27 46.67 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . 0.431 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 54.7 t30 -81.35 91.19 6.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.128 0.49 . . . . 0.0 110.451 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.66 -24.97 9.52 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -59.98 2.46 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' THR . . . . . 0.519 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.7 p -127.82 13.46 6.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -176.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . 0.724 ' HB2' ' HB3' ' B' ' 79' ' ' PHE . . . -46.15 -44.36 15.79 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.448 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.6 -53.52 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.027 0.442 . . . . 0.0 110.488 179.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.519 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.48 -34.91 78.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.264 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.662 ' O ' HG23 ' B' ' 92' ' ' VAL . 13.5 mt-10 -67.5 -44.22 78.99 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . 0.595 ' HD3' HG21 ' B' ' 63' ' ' ILE . 22.5 ttp180 -55.42 -47.08 76.52 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.133 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -42.28 99.27 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.57 -1.65 . . . . 0.0 112.466 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.47 -43.65 76.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.72 0.236 . . . . 0.0 111.078 179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.932 HG11 HD13 ' B' ' 26' ' ' LEU . 35.2 t -60.28 -44.45 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 177.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' B' ' 97' ' ' GLN . 0.5 OUTLIER -58.18 -54.87 42.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.089 178.337 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . 0.589 ' HA ' ' NE2' ' B' ' 97' ' ' GLN . 4.2 m-20 -56.73 -53.95 51.88 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.195 -179.069 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . 0.651 ' HG ' HD11 ' B' ' 99' ' ' LEU . 13.5 tp -61.56 -32.67 72.76 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.472 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.63 -41.12 65.86 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 97' ' ' GLN . . . . . 0.589 ' NE2' ' HA ' ' B' ' 94' ' ' ASP . 7.4 mt-30 -63.08 -22.67 67.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.149 0.976 . . . . 0.0 108.684 178.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.63 -47.42 9.2 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.793 -1.549 . . . . 0.0 111.439 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 99' ' ' LEU . . . . . 0.651 HD11 ' HG ' ' B' ' 95' ' ' LEU . 14.7 mt -80.05 -47.76 14.35 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.124 -1.398 . . . . 0.0 114.757 -176.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.87 ' HB3' ' HD2' ' B' ' 104' ' ' LYS . 59.2 mt -52.55 -56.97 17.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -176.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.632 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.1 Cg_exo -56.83 -13.19 10.74 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.711 2.274 . . . . 0.0 113.875 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -87.15 -9.5 55.09 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.368 -0.208 . . . . 0.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -123.94 -20.86 5.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.496 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.87 ' HD2' ' HB3' ' B' ' 100' ' ' LEU . 5.7 mtpm? -75.25 -178.99 4.19 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.925 0.393 . . . . 0.0 110.902 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . 0.459 HH12 ' CG ' ' A' ' 409' ' ' ASP . 0.3 OUTLIER -55.7 145.87 22.69 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.462 178.584 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . 0.474 ' HA ' ' HZ1' ' B' ' 106' ' ' LYS . 0.1 OUTLIER -84.51 75.27 10.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -178.267 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -123.08 15.39 9.9 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 176.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 1.7 p30 . . . . . 0 C--N 1.32 -0.696 0 CA-C-N 112.805 -1.998 . . . . 0.0 107.932 -178.611 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.984 ' HG3' ' HE2' ' B' ' 62' ' ' LYS . 0.5 OUTLIER . . . . . 0 CA--C 1.51 -0.567 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 400' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -138.44 84.46 2.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.203 -178.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.544 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -139.09 -49.49 0.51 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.234 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -71.29 11.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.602 0.715 . . . . 0.0 110.177 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.728 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -54.76 114.12 1.59 Allowed 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.186 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 . . . . . 0 C--N 1.317 -0.835 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.268 -177.88 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 99.0 t . . . . . 0 N--CA 1.452 -0.356 0 CA-C-O 121.19 0.519 . . . . 0.0 111.471 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.5 mt -95.57 -29.51 14.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.498 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.605 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.07 123.91 26.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.749 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.442 HG23 ' CE1' ' B' ' 25' ' ' TYR . 55.5 mt -108.95 122.65 63.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.267 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.839 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.9 t -115.07 150.05 17.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.611 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.66 177.25 4.74 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.064 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.579 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.15 75.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 125.555 1.784 . . . . 0.0 112.971 -178.654 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.611 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.1 t -123.82 119.7 57.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.1 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.593 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 30.8 mtp180 -89.42 128.42 35.94 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.858 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.41 ' NE2' ' HD2' ' B' ' 18' ' ' LYS . 14.7 tm0? -126.9 104.33 7.97 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.559 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.68 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.22 50.88 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.771 179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.26 26.13 10.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.752 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.523 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.1 tt0 -138.31 121.59 17.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.776 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.436 ' HA ' ' HA ' ' B' ' 16' ' ' ARG . 2.1 t70 -76.94 154.0 34.06 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.894 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -178.27 -156.12 15.97 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.218 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 133.57 48.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.955 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.47 142.19 29.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.516 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' TYR . . . . . 0.442 ' CE1' HG23 ' B' ' 11' ' ' ILE . 50.3 m-85 -137.72 110.59 7.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.97 HD11 HG13 ' B' ' 92' ' ' VAL . 9.3 mt -87.97 128.45 35.38 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 12.5 mtt -108.24 166.6 10.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.63 -47.91 14.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -117.11 3.68 12.71 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -156.11 153.24 29.02 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.624 -0.83 . . . . 0.0 112.515 -177.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.998 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.78 121.43 52.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.09 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.08 153.74 37.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.913 0.387 . . . . 0.0 110.783 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.955 ' HB2' HD12 ' B' ' 24' ' ' LEU . 45.6 t90 -147.26 134.17 20.21 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.475 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -111.98 127.41 26.9 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.714 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.502 ' HG2' ' HB2' ' B' ' 38' ' ' LYS . 58.9 Cg_endo -75.05 142.69 28.0 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.461 2.107 . . . . 0.0 111.801 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -58.77 133.6 56.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.721 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.11 -5.81 75.66 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.398 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.502 ' HB2' ' HG2' ' B' ' 35' ' ' PRO . 1.7 mppt? -113.39 153.55 28.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -98.04 -11.94 22.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.3 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -118.66 152.9 35.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.081 0.467 . . . . 0.0 112.002 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.475 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 21.7 m-85 -81.19 122.8 27.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.6 p -91.58 -8.72 46.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.269 0.557 . . . . 0.0 110.328 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.684 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 15.2 mm -117.08 119.54 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.189 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.3 t -148.0 101.52 3.3 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.474 ' CD2' HG23 ' B' ' 43' ' ' ILE . 73.8 m-70 -124.87 137.72 54.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.004 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.485 ' HB2' ' OD2' ' B' ' 49' ' ' ASP . 21.6 mmm -86.53 140.27 30.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.645 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.7 m-85 -57.56 -23.08 48.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.846 0.355 . . . . 0.0 110.544 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.13 -20.48 61.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.968 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.579 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -98.55 -8.89 25.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.087 0.47 . . . . 0.0 110.318 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.693 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.7 mm -87.43 127.66 40.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.434 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 7.6 tttp -88.44 -46.67 8.95 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.548 0.689 . . . . 0.0 109.727 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.667 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.8 p -154.48 -177.9 6.78 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.145 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 53' ' ' GLN . . . . . 0.598 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 10.3 pt20 -144.18 143.34 31.04 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.717 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.002 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 25.7 mttp -113.08 153.04 28.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.501 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -130.06 127.04 62.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 176.202 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -87.51 120.0 70.95 Favored Pre-proline 0 C--O 1.249 1.041 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.51 172.94 12.41 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 124.864 3.709 . . . . 0.0 113.928 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -61.76 160.3 12.06 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.888 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.01 8.1 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.59 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 5.2 mttp -85.11 162.96 19.06 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.26 -5.85 46.76 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.308 0.575 . . . . 0.0 110.478 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.984 ' HE2' ' HG3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -146.86 157.73 43.73 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.373 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.611 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -96.64 134.44 34.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.563 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 97.4 mt-30 -135.5 163.24 30.52 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.596 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -141.83 153.22 44.34 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 113.547 -1.66 . . . . 0.0 107.377 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.002 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -146.54 139.68 25.58 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 119.052 0.842 . . . . 0.0 111.256 178.742 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.998 HD11 HD13 ' B' ' 31' ' ' ILE . 96.2 mt -94.23 104.58 16.58 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.77 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.667 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.5 t -91.36 111.71 24.28 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.482 HD22 HD13 ' B' ' 50' ' ' ILE . 5.2 mt -94.23 157.57 15.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.579 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -79.02 -4.77 51.73 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.423 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.8 -5.61 53.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.636 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.6 20.69 50.45 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 73' ' ' ASP . . . . . 0.409 ' HB3' HD12 ' B' ' 69' ' ' LEU . 20.9 t70 -125.91 158.78 34.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.354 -0.423 . . . . 0.0 110.415 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.552 HG22 ' HA ' ' B' ' 68' ' ' VAL . 16.1 p -137.5 131.14 31.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.836 0.351 . . . . 0.0 110.316 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.539 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.13 101.09 10.6 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.062 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.51 137.92 32.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.207 0.527 . . . . 0.0 111.719 -178.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.684 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 53.2 m-85 -122.77 111.46 16.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.899 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.593 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.8 t-160 -88.43 104.14 16.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.132 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.596 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 58.4 m-85 -75.09 100.22 4.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.14 -2.02 47.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.579 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.2 t-20 -79.78 91.29 5.31 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.27 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.86 -37.77 9.32 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 52.4 m -53.85 -59.42 4.65 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.534 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.6 p -127.57 9.94 6.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -176.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.512 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.41 -48.9 7.17 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.549 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.1 -51.87 67.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.983 0.421 . . . . 0.0 110.87 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.534 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 7.6 mttt -67.48 -34.92 78.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.053 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.661 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.9 mt-10 -64.64 -46.86 80.73 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.234 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.611 ' HD3' HG23 ' B' ' 63' ' ' ILE . 25.3 ttp180 -53.83 -47.73 70.63 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.88 -46.47 87.7 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.6 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.08 -42.39 89.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 118.137 0.426 . . . . 0.0 111.164 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.97 HG13 HD11 ' B' ' 26' ' ' LEU . 47.9 t -60.95 -43.87 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.598 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.3 ttpm? -59.52 -55.21 37.49 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.843 178.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.75 -54.12 42.65 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.908 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.733 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.5 tp -61.99 -38.36 88.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.807 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.411 HD12 HG12 ' B' ' 92' ' ' VAL . 24.7 mt -70.58 -43.31 69.66 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 97' ' ' GLN . . . . . 0.408 ' N ' HE22 ' B' ' 53' ' ' GLN . 37.3 mt-30 -63.69 -21.13 66.23 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 122.158 0.98 . . . . 0.0 109.051 178.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -84.15 -50.59 7.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.159 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.733 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.4 mt -78.62 -46.68 18.71 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -176.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.693 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.2 mt -49.86 -60.07 5.74 Favored Pre-proline 0 N--CA 1.468 0.443 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -176.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.87 -13.88 37.46 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.17 1.913 . . . . 0.0 113.828 -178.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 18.9 mtmm -87.78 -6.34 58.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.433 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 . . . . . 0 C--N 1.327 -0.379 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.802 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.946 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.8 tt0 . . . . . 0 CA--C 1.508 -0.657 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.457 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -132.24 93.09 3.2 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.441 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.508 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.9 p-10 -138.42 -45.34 0.5 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.618 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -74.12 13.37 0.56 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.723 0.773 . . . . 0.0 110.645 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 1.028 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.52 123.93 17.89 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.547 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.773 -179.332 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 80.2 t . . . . . 0 CA--C 1.518 -0.252 0 CA-C-O 121.053 0.454 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.474 ' HB2' HD21 ' B' ' 95' ' ' LEU . 48.5 mt -94.94 -29.06 14.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.393 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.41 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.7 tp -142.61 138.32 30.66 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.8 mt -121.57 121.59 64.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.1 t -112.06 149.21 14.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.819 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.551 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.71 178.16 4.56 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.977 -179.63 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.525 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 12.7 mtpt 17.94 74.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 O-C-N 125.344 1.653 . . . . 0.0 113.727 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 13' ' ' LYS . 50.2 t -119.28 121.61 66.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.773 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.624 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 95.6 mtt180 -89.26 135.73 33.42 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.193 0.521 . . . . 0.0 111.464 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -130.57 106.53 8.56 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.627 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.5 OUTLIER 63.49 49.97 2.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.033 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.7 OUTLIER 70.7 25.6 4.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.205 178.754 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.522 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.8 tt0 -134.96 119.5 18.07 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.089 -0.244 . . . . 0.0 111.212 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.64 153.31 43.62 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.47 -157.95 19.51 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.314 -0.469 . . . . 0.0 112.474 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -129.33 132.18 47.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.833 0.349 . . . . 0.0 110.334 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.901 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -97.43 130.95 44.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.029 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -124.05 128.43 49.33 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.872 HD11 HG13 ' B' ' 92' ' ' VAL . 22.2 mt -108.47 118.01 35.67 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -98.65 165.22 11.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.026 179.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.8 -50.65 44.11 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.309 -0.86 . . . . 0.0 113.226 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -104.49 -3.75 23.57 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 167.2 30.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 119.421 -0.912 . . . . 0.0 112.704 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.805 HD12 HD11 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -115.9 125.66 73.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.664 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -129.92 119.02 22.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.236 0.541 . . . . 0.0 111.424 -178.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.901 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.8 t90 -112.05 133.82 53.98 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.002 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.483 ' HB2' ' CD2' ' B' ' 41' ' ' PHE . . . -115.67 135.28 22.64 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.231 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.828 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -74.1 150.84 43.52 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.576 2.184 . . . . 0.0 111.617 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -61.32 133.22 55.62 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.182 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.91 8.92 86.06 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.805 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.828 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.37 146.58 39.23 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.45 -0.441 . . . . 0.0 110.505 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 39' ' ' ASP . . . . . 0.465 ' OD2' ' HD2' ' B' ' 40' ' ' ARG . 2.4 p-10 -94.99 0.39 54.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.473 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.465 ' HD2' ' OD2' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -136.39 151.65 49.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.104 0.478 . . . . 0.0 111.785 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.483 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 35.5 m-85 -82.24 121.77 27.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.393 -0.821 . . . . 0.0 108.94 178.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.2 p -86.5 -19.8 28.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.162 0.506 . . . . 0.0 110.3 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.789 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 49.5 mm -108.63 110.68 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.803 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 7.5 t -137.69 101.6 4.51 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 79.9 m80 -129.13 144.24 51.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.045 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.468 ' O ' HG12 ' B' ' 50' ' ' ILE . 76.6 mmm -88.58 143.94 26.63 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.711 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -61.82 -18.97 61.95 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.89 -15.02 60.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.506 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.603 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.69 -6.02 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 109.983 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.663 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.9 mm -90.42 129.23 41.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.471 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 11.2 ttpt -86.32 -33.44 20.6 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.24 0.543 . . . . 0.0 109.825 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.527 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 27.5 p -178.38 -178.16 0.6 Allowed 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.089 -0.96 . . . . 0.0 108.638 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 53' ' ' GLN . . . . . 0.443 ' OE1' HD12 ' B' ' 100' ' ' LEU . 5.4 pm0 -134.89 140.94 46.18 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.996 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.091 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 47.1 mttp -102.2 145.29 29.62 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.353 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.528 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -124.15 129.39 74.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.099 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 176.677 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.494 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -90.17 117.52 68.12 Favored Pre-proline 0 C--O 1.251 1.138 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.59 173.03 10.49 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 125.165 3.91 . . . . 0.0 114.441 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.7 mp0 -61.12 160.48 10.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.069 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.76 -28.94 8.13 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.946 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.8 mttp -87.79 152.8 21.84 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.65 -20.34 66.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.228 0.537 . . . . 0.0 110.322 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.735 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.1 OUTLIER -135.48 144.0 46.15 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.923 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.658 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -85.44 142.36 13.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.54 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 95.5 mt-30 -141.01 163.51 32.78 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.421 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -141.96 153.46 44.34 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.039 -1.437 . . . . 0.0 108.04 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.091 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.71 146.03 30.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 119.045 0.839 . . . . 0.0 110.678 178.18 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.805 HD11 HD12 ' B' ' 31' ' ' ILE . 55.7 mt -97.19 106.65 19.01 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.149 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.592 ' HA ' HG22 ' B' ' 74' ' ' THR . 14.1 t -91.72 124.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.45 HD22 HD13 ' B' ' 50' ' ' ILE . 5.5 mt -108.08 153.91 22.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.022 0.439 . . . . 0.0 112.151 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.603 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -76.06 -5.48 46.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.768 0.794 . . . . 0.0 108.977 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.2 -4.64 48.67 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.6 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.26 20.68 51.77 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.465 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 73' ' ' ASP . . . . . 0.447 ' HB3' HD12 ' B' ' 69' ' ' LEU . 23.5 t70 -126.2 160.47 30.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.561 -0.32 . . . . 0.0 110.509 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.592 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.8 p -141.65 131.22 23.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.048 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.577 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 10.5 m -110.21 104.17 12.96 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.106 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.4 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 7.5 m-20 -82.26 153.58 25.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.235 0.54 . . . . 0.0 112.206 -178.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.789 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 64.5 m-85 -140.02 111.31 7.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.857 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.624 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.78 112.01 21.29 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.731 ' HE2' ' HB3' ' B' ' 88' ' ' GLU . 20.6 m-85 -76.91 92.52 3.66 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.067 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.2 9.16 34.88 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.35 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.525 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 52.2 t30 -84.76 92.75 8.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.03 0.443 . . . . 0.0 110.238 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -49.85 -32.0 13.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.678 -178.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.99 -60.63 3.02 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -178.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.481 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.7 p -128.27 14.19 6.67 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.707 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.96 -46.02 10.85 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.412 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.56 -54.52 33.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.481 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -64.66 -37.64 88.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.229 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.731 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 14.2 mt-10 -65.5 -45.17 84.61 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.278 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.658 ' HD3' HG23 ' B' ' 63' ' ' ILE . 19.2 ttp180 -54.99 -47.02 75.18 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.03 -44.96 95.59 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 113.536 -1.665 . . . . 0.0 112.568 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.93 -42.09 81.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 117.841 0.291 . . . . 0.0 111.073 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.872 HG13 HD11 ' B' ' 26' ' ' LEU . 34.0 t -62.41 -42.21 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.17 -56.2 25.18 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.579 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.09 -52.59 63.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.087 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.724 ' HG ' HD12 ' B' ' 99' ' ' LEU . 15.1 tp -61.96 -42.54 99.24 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.038 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.491 HD12 HG12 ' B' ' 92' ' ' VAL . 19.1 mt -68.23 -43.47 77.88 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.73 -21.31 65.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.361 1.077 . . . . 0.0 109.347 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.42 -50.93 6.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.164 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.724 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.8 mt -74.28 -50.88 17.08 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 113.452 -1.704 . . . . 0.0 114.675 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.711 HD23 ' HB3' ' B' ' 47' ' ' TYR . 40.5 mt -49.87 -57.53 12.12 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.613 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 62.2 Cg_exo -54.84 -16.92 12.51 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.614 2.209 . . . . 0.0 114.076 -179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -87.52 -13.65 42.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.754 0.312 . . . . 0.0 110.945 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.793 -179.091 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.921 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.1 tt0 . . . . . 0 CA--C 1.515 -0.389 0 CA-C-O 120.89 0.376 . . . . 0.0 110.463 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.509 ' HB2' ' CD2' ' A' ' 403' ' ' PHE . 9.4 p-10 -135.64 92.1 2.79 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.351 0.596 . . . . 0.0 112.241 -177.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.518 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.3 p-10 -139.48 -46.99 0.46 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -73.14 11.56 0.7 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.786 0.803 . . . . 0.0 110.44 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.888 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -55.49 116.14 2.71 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.39 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.572 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 95.5 t . . . . . 0 CA--C 1.519 -0.247 0 CA-C-O 121.048 0.451 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.426 ' HB2' HD21 ' B' ' 95' ' ' LEU . 25.7 mt -97.53 -29.75 13.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.841 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.0 tp -139.5 140.4 37.2 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 79.4 mt -122.59 121.94 64.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.775 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.3 t -111.96 148.21 15.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.929 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.597 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.03 175.68 5.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.556 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.1 79.68 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 O-C-N 125.393 1.683 . . . . 0.0 113.61 -179.62 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.597 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.6 t -130.74 126.98 61.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 114.878 -1.056 . . . . 0.0 108.957 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.591 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 9.2 mtm180 -95.16 144.87 25.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.608 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.8 110.33 6.68 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 13.0 tppt? 67.82 52.19 0.74 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.627 0.727 . . . . 0.0 110.003 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 62.89 25.28 14.99 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.869 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.555 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.6 pt20 -138.32 131.72 30.49 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.98 -0.45 . . . . 0.0 110.263 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.418 ' HA ' ' HA ' ' B' ' 16' ' ' ARG . 2.1 t70 -82.72 153.52 25.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -177.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.11 -154.77 12.42 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.914 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 136.65 50.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.085 0.469 . . . . 0.0 110.077 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.941 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.44 141.79 30.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.938 -178.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 40.2 m-85 -133.19 122.54 24.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.857 HD11 HG13 ' B' ' 92' ' ' VAL . 19.6 mt -104.34 120.67 41.71 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.8 -178.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -100.99 161.61 13.47 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.19 -20.41 65.39 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -107.78 -20.2 13.29 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -161.9 167.67 24.28 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.824 -176.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.855 HD13 HD11 ' B' ' 67' ' ' LEU . 1.1 tt -109.65 117.71 55.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -119.05 152.65 36.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.969 0.414 . . . . 0.0 110.752 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.941 ' HB2' HD12 ' B' ' 24' ' ' LEU . 38.3 t90 -147.32 140.78 25.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.408 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -125.51 138.16 31.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.944 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' B' ' 34' ' ' ALA . 12.5 Cg_exo -68.33 153.6 73.89 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.644 2.229 . . . . 0.0 111.374 179.278 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -65.23 116.01 6.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.964 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.96 4.1 54.48 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.432 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.549 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -97.36 143.22 28.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.582 0.706 . . . . 0.0 111.253 179.762 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.63 -14.29 52.28 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.494 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.42 156.81 45.23 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.939 0.399 . . . . 0.0 111.463 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -75.69 131.49 39.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.187 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -92.61 -28.93 16.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.442 0.639 . . . . 0.0 109.752 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.784 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 16.7 mm -97.57 123.84 50.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.404 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 31.2 t -147.99 101.45 3.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.486 ' CD2' HG23 ' B' ' 43' ' ' ILE . 85.0 m-70 -124.61 128.74 49.35 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.67 0.272 . . . . 0.0 110.816 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.529 ' O ' HG12 ' B' ' 50' ' ' ILE . 0.0 OUTLIER -78.96 139.72 38.17 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.869 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.565 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -58.84 -24.32 61.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.65 -8.74 57.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.57 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.71 ' HA ' ' HE2' ' B' ' 70' ' ' HIS . 0.9 OUTLIER -111.63 -10.14 14.12 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.282 0.563 . . . . 0.0 110.289 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.652 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.1 mm -91.94 130.2 41.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.434 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 11.1 tttp -89.78 -46.25 8.72 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.435 0.636 . . . . 0.0 110.08 -179.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.541 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -155.95 -177.88 6.9 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.679 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 53' ' ' GLN . . . . . 0.409 ' HG2' ' HB3' ' B' ' 96' ' ' LEU . 1.5 pp0? -146.48 143.11 28.74 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.713 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.097 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 46.2 mttp -108.76 156.62 19.41 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.985 0.421 . . . . 0.0 110.123 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.533 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.9 OUTLIER -132.11 130.04 60.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 176.27 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.512 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.36 117.81 68.54 Favored Pre-proline 0 C--O 1.25 1.121 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.19 173.45 12.21 Favored 'Trans proline' 0 C--N 1.344 0.298 1 C-N-CA 125.357 4.038 . . . . 0.0 114.544 -177.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.68 160.56 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.09 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.85 -29.27 7.89 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.921 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.9 mttp -91.34 150.58 21.23 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.28 -4.24 21.03 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.134 0.492 . . . . 0.0 110.742 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.411 ' CE ' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -141.81 143.94 33.68 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.756 -179.397 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.644 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -90.55 136.62 23.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.512 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 78.6 mt-30 -138.17 163.35 31.9 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -141.09 154.03 45.74 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.184 -1.371 . . . . 0.0 107.964 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.097 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.71 143.67 28.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 118.927 0.785 . . . . 0.0 111.21 178.368 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.855 HD11 HD13 ' B' ' 31' ' ' ILE . 77.4 mt -96.02 109.77 22.12 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.138 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.583 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.7 t -95.41 108.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.499 HD22 HD13 ' B' ' 50' ' ' ILE . 4.1 mt -92.06 156.17 17.58 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.045 0.45 . . . . 0.0 112.008 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.71 ' HE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -80.18 1.13 29.44 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.347 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.49 -7.61 59.63 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.251 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.0 17.56 47.03 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.745 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.22 159.37 33.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.7 0.286 . . . . 0.0 110.711 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.583 HG22 ' HA ' ' B' ' 68' ' ' VAL . 20.8 p -135.35 130.86 35.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.885 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.536 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.18 102.42 11.56 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.367 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -82.22 142.72 31.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.465 0.65 . . . . 0.0 111.742 -178.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.784 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 52.2 m-85 -126.79 115.25 19.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.206 179.187 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.591 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.0 t60 -87.2 110.64 20.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.866 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.767 ' HE2' ' HB3' ' B' ' 88' ' ' GLU . 26.8 m-85 -81.56 93.23 6.66 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.1 4.02 52.86 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.556 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -81.79 91.27 6.47 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 121.212 0.53 . . . . 0.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.7 -39.95 5.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.423 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -59.64 4.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.192 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.472 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.1 p -127.61 10.43 6.64 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.47 -46.86 9.88 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.402 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.99 -53.88 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.84 0.352 . . . . 0.0 110.772 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 3.8 mttt -65.49 -35.89 82.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.057 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.767 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.5 mt-10 -65.37 -47.26 77.0 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.644 ' HD3' HG23 ' B' ' 63' ' ' ILE . 22.3 ttp180 -54.43 -47.57 72.66 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.015 0.912 . . . . 0.0 108.596 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.39 -45.73 91.8 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.662 -1.608 . . . . 0.0 112.357 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.14 -40.71 90.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.909 0.322 . . . . 0.0 110.998 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.857 HG13 HD11 ' B' ' 26' ' ' LEU . 40.9 t -62.92 -43.45 98.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 177.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.76 -55.38 35.88 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.588 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -53.46 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.463 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.868 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.7 tp -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.272 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.435 HD12 HG12 ' B' ' 92' ' ' VAL . 30.9 mt -71.01 -47.75 57.03 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 117.663 0.21 . . . . 0.0 110.981 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.41 -17.83 63.08 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.76 0.791 . . . . 0.0 109.757 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -88.3 -48.45 7.66 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.863 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.868 HD12 ' HG ' ' B' ' 95' ' ' LEU . 9.9 mt -79.29 -47.46 15.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.087 -1.415 . . . . 0.0 114.538 -177.053 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.652 HD22 ' HB ' ' B' ' 50' ' ' ILE . 26.5 mt -49.81 -53.88 37.74 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 17.4 Cg_endo -57.45 -18.52 31.94 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.332 2.021 . . . . 0.0 113.4 -179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -87.58 -8.52 56.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.715 0.293 . . . . 0.0 111.292 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.328 -179.883 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.627 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.508 -0.671 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.435 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 3.9 m-20 -139.83 87.48 2.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.52 ' C ' ' H ' ' A' ' 403' ' ' PHE . 1.3 p30 -138.45 -48.62 0.53 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -67.98 6.89 0.62 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.636 0.732 . . . . 0.0 110.637 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.949 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.56 120.3 7.52 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.766 179.107 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.78 -178.677 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.3 t . . . . . 0 CA--C 1.514 -0.425 0 CA-C-O 121.199 0.523 . . . . 0.0 111.126 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 34.7 mt -91.37 -33.3 15.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.181 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tp -131.21 127.48 37.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.992 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 71.1 mt -110.21 124.25 66.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.863 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.4 t -115.65 150.24 17.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.331 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.613 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -115.47 178.0 4.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.3 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.589 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.44 70.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 O-C-N 125.294 1.621 . . . . 0.0 113.245 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.613 HG23 ' O ' ' B' ' 13' ' ' LYS . 19.7 t -119.1 131.26 72.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.022 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.707 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 98.9 mtt180 -101.96 139.2 37.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.316 0.579 . . . . 0.0 111.301 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.568 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -134.84 109.57 8.61 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.968 -1.014 . . . . 0.0 108.728 179.039 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.95 41.43 6.58 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.477 0.485 . . . . 0.0 110.914 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.1 tptp 73.95 27.3 1.65 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.548 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.707 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 35.8 mt-30 -125.82 124.24 40.49 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -85.78 139.36 31.38 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.013 0.196 . . . . 0.0 110.798 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.575 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -172.96 -153.71 9.74 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.51 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.29 137.85 52.93 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.948 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.61 142.28 33.21 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.736 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -136.44 120.68 17.9 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.875 HD11 HG13 ' B' ' 92' ' ' VAL . 15.2 mt -100.27 120.66 40.26 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.636 -0.425 . . . . 0.0 111.28 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.6 mpt? -96.51 166.91 11.46 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.12 66.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -116.62 -0.89 12.28 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ARG . . . . . 0.463 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 16.8 ptt180 -157.13 158.69 36.81 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 119.158 -1.017 . . . . 0.0 112.699 -177.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 1.003 HD13 HD11 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -110.39 121.62 63.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.73 178.658 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.85 150.43 42.88 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.038 0.447 . . . . 0.0 110.662 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.948 ' HB2' HD12 ' B' ' 24' ' ' LEU . 31.1 t90 -146.99 139.83 25.1 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -131.1 137.52 30.88 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.575 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 22.1 Cg_exo -64.52 160.93 37.27 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.515 2.143 . . . . 0.0 111.515 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.44 131.26 50.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.191 0.519 . . . . 0.0 111.358 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.01 29.85 68.51 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.078 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 21.8 mmtm -113.7 147.55 37.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 117.023 0.412 . . . . 0.0 110.46 179.042 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -96.32 -14.65 22.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.044 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -124.02 146.7 48.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.45 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.421 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 45.4 m-85 -83.57 121.83 27.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.818 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 42' ' ' THR . . . . . 0.4 ' OG1' ' HD3' ' B' ' 35' ' ' PRO . 1.1 p -83.81 -21.13 32.2 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.262 0.553 . . . . 0.0 110.411 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.789 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 10.3 mm -106.28 124.39 61.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.56 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 42.3 t -147.78 101.45 3.32 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.827 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.516 ' CD2' HG23 ' B' ' 43' ' ' ILE . 73.4 m-70 -129.94 139.13 51.15 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.52 ' O ' HG12 ' B' ' 50' ' ' ILE . 79.6 mmm -92.4 142.77 27.06 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.698 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.7 m-85 -59.18 -21.3 59.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.25 0.548 . . . . 0.0 109.817 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 48' ' ' ALA . . . . . 0.594 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -68.38 -22.75 64.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.144 -0.935 . . . . 0.0 112.185 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.557 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -102.54 -10.92 18.91 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.999 0.428 . . . . 0.0 110.771 -179.426 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.678 ' HB ' HD22 ' B' ' 100' ' ' LEU . 0.9 OUTLIER -86.35 132.45 32.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.678 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -92.72 -55.34 3.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.609 0.719 . . . . 0.0 109.964 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.497 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -144.52 -177.45 5.5 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' GLN . . . . . 0.648 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 6.3 pt20 -141.87 145.85 35.1 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.694 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.069 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 49.3 mttp -107.16 147.05 30.59 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 177.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.732 ' HB ' ' HD3' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.92 123.46 62.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 176.365 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -88.97 120.27 69.94 Favored Pre-proline 0 C--O 1.245 0.868 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -69.53 172.69 11.96 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 124.415 3.41 . . . . 0.0 113.968 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.46 161.29 12.04 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.203 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.85 -28.96 7.75 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.627 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 6.4 mttp -85.24 161.36 19.6 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 175.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.02 -16.75 64.18 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.357 0.599 . . . . 0.0 110.496 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.52 ' HE2' ' HG3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -140.05 150.37 44.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.415 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.603 ' O ' ' HB2' ' B' ' 79' ' ' PHE . 4.1 mp -89.11 135.09 26.73 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -134.35 162.95 30.79 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -175.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.756 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -140.0 153.62 46.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.968 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.069 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.45 145.51 30.24 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 119.232 0.924 . . . . 0.0 110.72 178.26 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 1.003 HD11 HD13 ' B' ' 31' ' ' ILE . 95.6 mt -94.74 109.08 21.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.421 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.536 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.0 t -95.36 108.72 21.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.53 HD22 HD13 ' B' ' 50' ' ' ILE . 5.2 mt -88.77 155.83 19.33 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.102 -177.267 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.557 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -79.23 -1.58 37.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.666 0.746 . . . . 0.0 109.034 178.294 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -5.91 58.71 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.584 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.5 20.45 44.65 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.556 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 73' ' ' ASP . . . . . 0.525 ' HB3' HD12 ' B' ' 69' ' ' LEU . 19.1 t70 -126.14 160.86 29.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.62 -0.29 . . . . 0.0 110.279 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.536 HG22 ' HA ' ' B' ' 68' ' ' VAL . 17.5 p -138.23 131.21 29.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.459 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.535 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.8 m -110.46 102.77 11.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.434 HD22 ' CG ' ' A' ' 400' ' ' ASP . 3.2 m-20 -82.99 144.63 29.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.552 0.691 . . . . 0.0 112.303 -177.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.789 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 46.5 m-85 -129.59 107.32 9.36 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.564 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.575 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.98 112.43 21.82 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.639 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.756 ' HE1' ' HB2' ' B' ' 65' ' ' LEU . 81.3 m-85 -83.56 95.98 8.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.92 5.47 51.56 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.27 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.589 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.4 t-20 -87.23 91.45 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.915 0.388 . . . . 0.0 110.015 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.06 -39.28 9.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.923 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.91 -59.44 4.33 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.53 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.61 10.41 6.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -44.99 -48.5 11.47 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.506 HG22 HG12 ' B' ' 63' ' ' ILE . 4.8 t -57.63 -52.14 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.15 0.5 . . . . 0.0 110.685 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.6 mttt -68.72 -33.63 74.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.61 ' HB3' ' CE2' ' B' ' 79' ' ' PHE . 11.3 mt-10 -65.79 -43.53 88.49 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.732 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 6.1 ttm105 -57.73 -43.71 85.51 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 177.38 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.22 -44.76 87.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.289 -1.323 . . . . 0.0 112.758 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.06 -45.11 74.77 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 117.784 0.266 . . . . 0.0 111.451 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.875 HG13 HD11 ' B' ' 26' ' ' LEU . 44.4 t -60.69 -43.19 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.648 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.4 ttpm? -59.27 -55.01 40.33 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.821 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -53.84 -54.33 39.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.474 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.637 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.2 tp -61.76 -41.71 98.05 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.349 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.488 HD12 HG12 ' B' ' 92' ' ' VAL . 22.1 mt -69.29 -44.62 71.42 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 117.876 0.307 . . . . 0.0 110.221 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 97' ' ' GLN . . . . . 0.511 ' N ' HE22 ' B' ' 53' ' ' GLN . 48.1 tp60 -62.0 -24.28 66.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.233 1.016 . . . . 0.0 109.079 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.464 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 2.0 mm-40 -84.97 -44.76 12.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.299 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.67 HD13 ' CE2' ' B' ' 47' ' ' TYR . 20.4 mt -81.06 -47.07 14.05 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.698 HD23 ' HB3' ' B' ' 47' ' ' TYR . 34.6 mt -50.15 -56.77 15.64 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -176.726 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 52.4 Cg_exo -57.09 -22.32 46.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.407 2.071 . . . . 0.0 114.094 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.464 ' HD3' ' O ' ' B' ' 98' ' ' GLN . 12.2 mtpt -88.53 -10.93 47.2 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.594 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 71.4 m-85 . . . . . 0 C--N 1.329 -0.29 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.677 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.918 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.51 -0.582 0 CA-C-O 120.513 0.197 . . . . 0.0 111.316 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 400' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 177.7 77.12 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.052 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.555 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.04 -54.2 0.58 Allowed 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -177.621 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 402' ' ' ASP . . . . . 0.416 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 3.9 p30 -69.9 11.5 0.29 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.728 0.775 . . . . 0.0 110.555 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 1.013 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.53 126.28 25.85 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.858 179.352 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.714 -178.865 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' B' ' 27' ' ' MET . 49.0 t . . . . . 0 N--CA 1.45 -0.442 0 CA-C-O 121.08 0.466 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.1 mt -97.37 -30.39 12.96 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.476 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 8.5 tp -131.76 127.31 36.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.837 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 75.8 mt -111.78 121.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.825 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -111.21 149.9 13.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.215 -179.228 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.586 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.65 176.94 4.86 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.841 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.546 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.0 mtpm? 18.17 72.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 O-C-N 125.352 1.657 . . . . 0.0 113.527 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.586 HG23 ' O ' ' B' ' 13' ' ' LYS . 18.6 t -119.83 124.52 72.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.577 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.581 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 4.8 mtp180 -89.19 120.21 30.37 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.179 0.514 . . . . 0.0 111.252 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.631 ' HG2' HG13 ' B' ' 43' ' ' ILE . 28.1 tp60 -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.21 37.57 2.08 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.24 23.81 7.68 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.336 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.539 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 54.0 tt0 -126.21 120.77 30.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.326 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.57 153.29 43.03 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.758 0.313 . . . . 0.0 111.808 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.43 ' HA2' ' N ' ' B' ' 36' ' ' GLU . . . 178.08 -154.9 15.83 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.783 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.98 132.87 49.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.997 0.427 . . . . 0.0 110.387 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -99.01 143.13 29.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.54 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -134.28 124.42 25.85 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.951 HD11 HG13 ' B' ' 92' ' ' VAL . 17.3 mt -105.13 110.17 22.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.349 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' MET . . . . . 0.424 ' HA ' ' HA ' ' B' ' 8' ' ' VAL . 2.2 mpt? -89.46 162.58 15.66 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.47 -23.64 62.9 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -116.23 -12.56 11.16 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -159.57 166.64 30.34 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 119.703 -0.799 . . . . 0.0 112.73 -176.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 1.031 HD13 HD11 ' B' ' 67' ' ' LEU . 1.1 tt -112.21 119.41 60.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.835 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -120.16 151.89 38.44 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.328 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.889 ' HB2' HD12 ' B' ' 24' ' ' LEU . 27.1 t90 -146.9 139.77 25.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -124.76 143.87 44.94 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.274 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.537 ' O ' ' HB2' ' B' ' 38' ' ' LYS . 28.3 Cg_exo -61.85 159.95 31.28 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.476 2.118 . . . . 0.0 111.662 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.43 ' N ' ' HA2' ' B' ' 22' ' ' GLY . 5.3 tp10 -57.34 130.52 46.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.21 0.529 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.0 29.81 75.75 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.031 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.15 151.28 31.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.056 0.428 . . . . 0.0 110.843 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -98.65 -22.08 16.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.013 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.405 ' H ' ' HG2' ' B' ' 40' ' ' ARG . 6.5 ptp180 -108.67 140.92 41.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.651 -178.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -84.74 124.59 31.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.011 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.4 p -92.58 -13.65 29.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.281 0.562 . . . . 0.0 110.594 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.739 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -114.09 124.89 71.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.135 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.0 t -147.81 102.84 3.45 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -124.5 137.41 54.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.488 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.7 mmm -89.16 138.89 31.02 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.694 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.7 m-85 -56.97 -24.39 52.82 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.301 0.572 . . . . 0.0 110.358 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.27 -32.65 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.614 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.571 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -91.58 -11.87 36.0 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 123.538 0.524 . . . . 0.0 111.604 -178.272 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.626 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.5 mm -83.57 135.69 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.413 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 18.0 ttpp -87.18 -47.69 8.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 4.7 p -167.73 -177.77 3.6 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.318 -1.31 . . . . 0.0 108.273 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -135.05 144.04 47.05 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.616 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.013 ' HD3' ' HB3' ' A' ' 403' ' ' PHE . 48.1 mttp -102.16 148.31 25.56 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.535 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -125.78 127.84 71.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 176.542 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.434 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.9 p -91.3 115.62 64.78 Favored Pre-proline 0 C--O 1.25 1.111 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 59.7 Cg_endo -67.6 173.14 9.36 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 125.125 3.883 . . . . 0.0 114.042 -177.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -59.28 160.05 7.01 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.123 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.52 -29.05 8.13 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.534 -1.427 . . . . 0.0 109.534 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.596 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 5.1 mttm -86.9 153.18 21.81 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.37 -16.21 64.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.242 0.544 . . . . 0.0 110.493 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.918 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.31 138.38 38.31 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.926 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.63 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -80.34 131.61 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.54 162.91 30.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -176.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.689 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -140.38 153.89 46.52 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.068 -1.424 . . . . 0.0 107.719 177.121 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.005 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -145.7 142.43 28.98 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.973 0.806 . . . . 0.0 110.483 178.176 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 1.031 HD11 HD13 ' B' ' 31' ' ' ILE . 39.8 mt -94.0 106.94 18.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.024 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.511 ' HA ' HG22 ' B' ' 74' ' ' THR . 8.1 t -94.24 113.84 29.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.042 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.542 HD22 HD13 ' B' ' 50' ' ' ILE . 3.2 mt -98.36 158.9 15.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.021 0.439 . . . . 0.0 112.066 -177.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.571 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -81.18 0.02 38.38 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.297 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.67 -3.47 56.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.531 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.91 19.96 56.68 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 73' ' ' ASP . . . . . 0.42 ' HB3' HD12 ' B' ' 69' ' ' LEU . 18.9 t70 -126.04 157.41 38.01 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.559 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 20.3 p -137.15 130.86 31.74 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.524 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 0.8 OUTLIER -107.96 105.34 15.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.157 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -86.36 128.46 34.94 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 112.534 -177.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.739 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 50.3 m-85 -114.32 110.03 19.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.397 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.581 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.5 t-160 -86.82 113.35 22.56 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.026 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.689 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 46.0 m-85 -80.18 92.33 5.68 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.31 27.66 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.926 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.546 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -107.14 91.33 3.61 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.383 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -35.51 4.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.19 -0.914 . . . . 0.0 113.337 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 57.1 m -58.88 -59.99 4.57 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.516 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.8 p -127.9 9.99 6.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.376 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.596 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -42.8 -50.15 5.68 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 113.863 1.061 . . . . 0.0 113.863 -177.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.462 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.92 -52.79 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.909 0.385 . . . . 0.0 110.992 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.516 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -66.73 -35.49 80.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.138 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.643 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.3 mt-10 -64.97 -45.46 85.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.63 ' HD3' HG23 ' B' ' 63' ' ' ILE . 20.6 ttp180 -55.22 -47.51 75.24 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.5 -45.27 93.77 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.799 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.7 -42.44 82.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 117.843 0.292 . . . . 0.0 111.26 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.951 HG13 HD11 ' B' ' 26' ' ' LEU . 45.8 t -62.36 -42.26 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -53.46 58.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.69 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 94' ' ' ASP . . . . . 0.419 ' HA ' ' HG2' ' B' ' 97' ' ' GLN . 2.9 m-20 -57.82 -54.65 44.46 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.045 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.824 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -60.67 -40.33 91.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.137 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.493 HD12 HG12 ' B' ' 92' ' ' VAL . 22.7 mt -69.72 -45.86 67.24 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.729 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 97' ' ' GLN . . . . . 0.419 ' HG2' ' HA ' ' B' ' 94' ' ' ASP . 19.4 pt20 -65.03 -18.39 65.26 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.745 0.783 . . . . 0.0 109.544 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.448 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 33.4 mm-40 -84.79 -50.86 7.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.981 178.442 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.824 HD12 ' HG ' ' B' ' 95' ' ' LEU . 9.3 mt -78.41 -45.91 21.18 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.694 HD23 ' HB3' ' B' ' 47' ' ' TYR . 32.7 mt -51.58 -51.23 71.58 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -176.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 45.4 Cg_endo -67.36 -24.96 42.57 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.198 1.932 . . . . 0.0 114.341 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 32.3 mttm -63.82 -31.67 72.93 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.003 0.43 . . . . 0.0 111.804 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 . . . . . 0 C--N 1.322 -0.621 0 CA-C-O 121.665 0.745 . . . . 0.0 110.485 -179.146 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.45 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 5.3 pt-20 . . . . . 0 C--O 1.222 -0.368 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.492 ' HB3' ' HE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.5 87.19 2.24 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.17 -176.799 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.526 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -138.75 -50.31 0.54 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.287 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.33 13.63 0.42 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.546 0.688 . . . . 0.0 110.264 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.92 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.62 127.51 31.74 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.144 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 . . . . . 0 C--N 1.317 -0.839 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.896 -178.566 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.6 t . . . . . 0 CA--C 1.515 -0.384 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.443 ' HB2' HD21 ' B' ' 95' ' ' LEU . 19.5 mt -88.28 -28.85 20.82 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.486 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.411 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -135.61 136.85 41.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.9 mt -121.66 120.14 60.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.797 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.5 t -110.89 150.02 13.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.463 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.548 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.1 mtmp? -116.4 175.89 5.35 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.406 -178.559 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.48 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.3 OUTLIER 17.87 70.9 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.679 0 O-C-N 125.346 1.654 . . . . 0.0 113.293 -178.527 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.548 HG23 ' O ' ' B' ' 13' ' ' LYS . 11.7 t -114.92 121.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.073 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.575 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 73.4 mtp85 -92.49 120.92 33.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.414 HE21 ' HB3' ' B' ' 17' ' ' GLN . 0.6 OUTLIER -113.27 103.37 11.25 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 178.311 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 57.5 mttp 63.76 56.44 1.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.076 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 68.51 21.23 8.19 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.765 177.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tt0 -133.7 122.6 23.61 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.831 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.03 153.44 43.2 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.92 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.668 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 177.98 -170.75 43.13 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 116.148 -0.478 . . . . 0.0 112.706 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 131.74 54.04 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.938 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.31 139.1 33.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.542 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' TYR . . . . . 0.457 ' CD2' ' HE1' ' B' ' 41' ' ' PHE . 71.3 m-85 -132.7 122.75 25.08 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.908 HD11 HG13 ' B' ' 92' ' ' VAL . 14.0 mt -102.11 116.43 32.66 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.458 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -93.99 162.45 13.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.44 -8.76 6.66 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -127.9 -16.13 4.7 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -158.24 160.5 37.19 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.439 -176.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 1.018 HD13 HD11 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.37 118.66 53.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.968 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.416 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -119.14 154.17 33.69 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.415 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.938 ' HB2' HD12 ' B' ' 24' ' ' LEU . 55.2 t90 -146.87 129.42 15.96 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.401 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -109.96 121.82 40.77 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.312 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.445 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 40.3 Cg_endo -69.03 139.46 42.82 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.469 2.112 . . . . 0.0 111.833 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.668 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.0 mt-10 -57.92 132.04 52.22 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.628 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.09 -7.48 64.53 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.141 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -113.37 152.94 29.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.583 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -97.55 -7.32 31.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.36 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -124.24 152.02 43.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.109 0.48 . . . . 0.0 111.938 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.457 ' HE1' ' CD2' ' B' ' 25' ' ' TYR . 44.8 m-85 -81.16 121.81 26.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.901 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 12.7 p -91.46 -9.85 43.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 110.111 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.79 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 19.0 mm -117.34 119.99 63.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.159 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 27.7 t -148.04 101.43 3.29 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.482 ' CD2' HG23 ' B' ' 43' ' ' ILE . 66.0 m-70 -125.99 132.95 51.93 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.49 ' O ' HG12 ' B' ' 50' ' ' ILE . 50.9 mtp -86.6 143.38 27.68 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.676 ' HB3' HD23 ' B' ' 100' ' ' LEU . 19.9 m-85 -59.92 -22.09 61.97 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.195 0.521 . . . . 0.0 109.959 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.86 -3.31 31.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.707 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.559 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 12.4 m-20 -118.78 -9.99 10.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.252 0.549 . . . . 0.0 110.105 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.804 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.3 mm -92.39 127.7 44.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.485 ' HB2' ' HB3' ' B' ' 70' ' ' HIS . 29.1 tttp -87.15 -49.49 7.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.477 0.656 . . . . 0.0 110.069 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.08 -177.43 5.91 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.188 -178.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 53' ' ' GLN . . . . . 0.43 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 24.3 pt20 -144.49 146.78 32.6 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.969 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.086 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 39.3 mttp -109.06 146.18 34.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 177.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.536 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -125.11 128.54 73.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 176.211 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -90.87 118.66 68.77 Favored Pre-proline 0 C--O 1.25 1.105 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -178.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.55 173.03 13.14 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 125.196 3.931 . . . . 0.0 114.017 -177.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -61.35 160.24 11.12 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.79 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.84 -28.97 8.09 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -177.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 3.6 mttm -87.41 164.78 16.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.44 -14.96 57.86 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.314 0.578 . . . . 0.0 109.924 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.462 ' HZ1' ' HB2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -133.46 129.79 37.72 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.445 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.442 HG21 ' HA ' ' B' ' 86' ' ' VAL . 2.7 mp -77.98 129.6 37.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 177.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -135.67 163.63 29.71 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.701 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.8 tp -138.84 153.43 48.34 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 113.069 -1.878 . . . . 0.0 106.906 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.086 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.32 140.98 26.83 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 119.07 0.85 . . . . 0.0 110.33 178.336 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 1.018 HD11 HD13 ' B' ' 31' ' ' ILE . 94.3 mt -94.02 111.22 22.91 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.444 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.621 ' HA ' HG22 ' B' ' 74' ' ' THR . 15.0 t -95.73 102.83 14.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.719 HD22 HD13 ' B' ' 50' ' ' ILE . 1.3 mt -84.06 152.89 24.11 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.942 -176.614 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.559 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 1.6 p-80 -81.38 6.4 14.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.695 0.759 . . . . 0.0 109.004 178.294 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.82 -22.04 46.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.226 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.93 4.51 24.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.184 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 73' ' ' ASP . . . . . 0.522 ' OD2' HD12 ' B' ' 69' ' ' LEU . 4.5 p-10 -126.65 175.95 7.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.075 0.464 . . . . 0.0 111.807 -179.178 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.621 HG22 ' HA ' ' B' ' 68' ' ' VAL . 14.2 p -136.85 146.83 46.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -179.242 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.545 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 18.6 m -122.24 103.47 8.79 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.108 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.446 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 6.8 m-20 -81.98 150.86 27.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.265 0.555 . . . . 0.0 112.273 -178.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.79 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.5 m-85 -137.34 117.85 13.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.31 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.495 ' HB3' ' O ' ' B' ' 16' ' ' ARG . 4.5 t-160 -92.15 113.69 26.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.708 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.701 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 65.2 m-85 -83.7 93.16 7.86 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.71 3.48 53.84 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.48 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.9 t-20 -85.1 91.19 8.05 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.09 -41.9 2.76 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.427 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.35 -59.84 3.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 20.8 p -127.78 7.93 6.25 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -176.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.506 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -41.1 -52.89 3.17 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.442 ' HA ' HG21 ' B' ' 63' ' ' ILE . 2.2 t -57.67 -49.11 81.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.544 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 5.8 mptt -70.06 -31.95 69.82 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.636 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.2 mt-10 -65.92 -44.1 86.15 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.482 ' HD2' HD12 ' B' ' 55' ' ' ILE . 23.4 ttp180 -56.51 -47.56 79.05 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 90' ' ' ASP . . . . . 0.672 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -63.39 -44.69 93.98 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.38 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.13 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.884 0.311 . . . . 0.0 111.424 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.908 HG13 HD11 ' B' ' 26' ' ' LEU . 57.0 t -59.81 -45.11 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.672 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.6 tmmt? -58.55 -54.56 45.72 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.007 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.07 -54.43 30.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.101 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.872 ' HG ' HD12 ' B' ' 99' ' ' LEU . 14.8 tp -65.29 -30.6 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.025 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.449 HD12 HG12 ' B' ' 92' ' ' VAL . 24.0 mt -76.18 -42.58 45.91 Favored 'General case' 0 C--O 1.216 -0.676 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -60.81 -24.52 65.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.379 1.085 . . . . 0.0 108.745 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.98 -46.62 11.86 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.551 -1.659 . . . . 0.0 111.363 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.872 HD12 ' HG ' ' B' ' 95' ' ' LEU . 11.5 mt -86.78 -28.11 23.18 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -176.072 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.804 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.3 mt -67.57 -58.64 8.15 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.051 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.0 -21.67 72.81 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.888 1.725 . . . . 0.0 112.993 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.522 ' HG2' ' HA ' ' B' ' 99' ' ' LEU . 3.8 ptmm? -87.91 2.2 52.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.598 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.475 ' HD2' ' O ' ' B' ' 99' ' ' LEU . 11.2 m-85 . . . . . 0 N--CA 1.463 0.211 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.734 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 20.9 tt0 . . . . . 0 CA--C 1.518 -0.275 0 N-CA-C 111.259 0.096 . . . . 0.0 111.259 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.566 ' HB3' ' HE2' ' A' ' 403' ' ' PHE . 5.1 m-20 -150.35 82.58 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.6 p-10 -139.01 -42.31 0.47 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.18 15.83 0.15 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.72 0.771 . . . . 0.0 110.93 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 1.088 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -55.86 132.31 49.21 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.693 179.307 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 . . . . . 0 C--N 1.315 -0.908 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.369 -178.858 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 90.9 t . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.802 0.334 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.414 ' HB2' HD21 ' B' ' 95' ' ' LEU . 45.3 mt -94.73 -30.36 14.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.618 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.0 tp -136.64 135.11 38.01 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 77.8 mt -118.55 119.55 61.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.722 HG21 HD23 ' B' ' 24' ' ' LEU . 2.8 t -108.46 148.64 12.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.812 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.572 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.11 173.59 6.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.114 -178.627 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 17.75 68.24 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 O-C-N 125.163 1.539 . . . . 0.0 114.214 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.572 HG23 ' O ' ' B' ' 13' ' ' LYS . 24.4 t -117.08 126.85 74.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.649 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 12.0 mtt180 -99.18 133.64 43.18 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.36 0.6 . . . . 0.0 111.65 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.543 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 38.5 tp60 -111.21 107.47 16.8 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.53 46.53 1.84 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.733 0.778 . . . . 0.0 109.264 -179.12 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.35 23.64 9.18 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.896 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.618 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.2 tt0 -122.16 119.19 30.57 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.381 -0.199 . . . . 0.0 110.776 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.498 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 1.2 m-20 -58.85 146.66 36.56 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.709 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 178.67 -169.39 40.89 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.082 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.28 137.2 53.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.979 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.48 137.79 35.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.917 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 25' ' ' TYR . . . . . 0.416 ' CD1' ' HE2' ' B' ' 41' ' ' PHE . 68.6 m-85 -131.96 117.4 18.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.784 HD11 HG13 ' B' ' 92' ' ' VAL . 12.3 mt -100.42 119.12 37.98 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.501 -178.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -95.44 161.85 13.9 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -20.43 63.14 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.54 -22.2 11.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -178.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ARG . . . . . 0.507 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 1.6 ptp180 -155.28 160.86 41.11 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.713 -0.795 . . . . 0.0 112.592 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.911 HD12 HD11 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -104.0 122.15 56.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 114.81 -1.086 . . . . 0.0 108.282 179.028 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.403 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -125.84 155.37 41.27 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.182 0.515 . . . . 0.0 111.29 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.979 ' HB2' HD12 ' B' ' 24' ' ' LEU . 50.4 t90 -147.23 134.69 20.83 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.904 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -117.67 133.77 23.27 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.033 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 1.005 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 2.3 Cg_endo -77.14 146.38 25.35 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.377 2.051 . . . . 0.0 111.923 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.709 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 34.3 mt-10 -64.01 129.46 40.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.297 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.45 -0.02 61.35 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.439 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 1.005 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.9 mptt -113.42 154.37 27.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.322 . . . . 0.0 110.768 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -100.94 4.72 42.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.451 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -140.03 157.17 46.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.209 0.528 . . . . 0.0 111.895 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.416 ' HE2' ' CD1' ' B' ' 25' ' ' TYR . 61.2 m-85 -85.21 126.05 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.756 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.7 p -93.07 -19.07 21.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.263 0.554 . . . . 0.0 110.381 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.704 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 37.1 mm -110.71 118.63 57.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.23 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 43.6 t -147.8 101.33 3.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -126.36 138.82 53.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.785 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.512 ' O ' HG12 ' B' ' 50' ' ' ILE . 18.9 mmt -84.33 144.23 28.98 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.676 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.8 m-85 -61.45 -20.6 63.3 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.962 0.41 . . . . 0.0 110.564 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.59 -11.36 60.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.436 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.541 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.05 -11.56 15.28 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.204 0.526 . . . . 0.0 109.655 179.277 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.682 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.2 mm -91.38 131.0 39.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.43 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 34.7 tttm -87.83 -43.38 11.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.359 0.6 . . . . 0.0 109.745 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.505 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.9 p -164.94 -177.59 4.75 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.261 -0.882 . . . . 0.0 109.602 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.67 142.2 41.13 Favored 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.126 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.088 ' HD3' ' HB3' ' A' ' 403' ' ' PHE . 50.2 mttp -105.28 150.89 24.76 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.55 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.95 129.39 71.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.826 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.463 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -93.41 121.49 64.97 Favored Pre-proline 0 C--O 1.252 1.21 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -68.15 172.89 10.29 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 125.071 3.847 . . . . 0.0 114.53 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -63.44 160.43 16.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.39 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.75 -29.19 7.97 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.734 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 22.7 mttp -88.47 155.2 19.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.05 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.47 -17.69 63.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.974 0.416 . . . . 0.0 110.991 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.607 ' HD3' ' CE1' ' B' ' 78' ' ' HIS . 17.3 pttt -132.47 134.21 44.78 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.731 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.604 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -78.84 134.9 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.63 ' OE1' ' HD3' ' B' ' 60' ' ' LYS . 0.2 OUTLIER -134.0 163.04 30.43 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 118.085 -1.446 . . . . 0.0 114.811 -176.165 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.428 ' HA ' ' O ' ' B' ' 54' ' ' LYS . 2.2 tp -141.95 153.51 44.38 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 113.111 -1.859 . . . . 0.0 107.24 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.033 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.53 141.71 28.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 118.93 0.787 . . . . 0.0 110.52 178.567 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.911 HD11 HD12 ' B' ' 31' ' ' ILE . 96.1 mt -93.83 100.28 12.49 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.884 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.642 ' HA ' HG22 ' B' ' 74' ' ' THR . 11.4 t -86.15 111.88 21.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.467 HD12 ' HB3' ' B' ' 73' ' ' ASP . 6.4 mt -94.26 156.6 16.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.998 0.428 . . . . 0.0 111.543 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.541 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -80.16 -1.4 40.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.248 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.28 -3.96 56.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.542 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.11 19.41 53.23 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.54 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 73' ' ' ASP . . . . . 0.467 ' HB3' HD12 ' B' ' 69' ' ' LEU . 21.7 t70 -125.96 158.9 34.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.254 . . . . 0.0 110.533 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.642 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.5 p -137.87 131.05 30.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.234 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.547 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.6 m -107.39 103.42 12.76 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.69 143.85 30.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.072 0.463 . . . . 0.0 112.162 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.704 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 41.6 m-85 -126.64 127.26 44.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.222 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.649 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.5 t-160 -92.37 101.3 13.77 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.178 -178.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.708 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 24.8 m-85 -79.37 99.52 7.19 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.79 9.9 24.69 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.8 91.43 7.05 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.636 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.83 -41.94 1.69 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.451 -178.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -59.75 4.78 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.452 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.7 p -127.79 7.34 6.18 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 115.747 1.758 . . . . 0.0 115.747 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.708 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.73 -47.33 7.87 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.4 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.76 -51.44 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 111.084 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.452 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.5 mptt -69.06 -34.26 74.88 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.053 0.454 . . . . 0.0 109.858 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.687 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.9 mt-10 -64.83 -44.42 89.9 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.604 ' HD3' HG23 ' B' ' 63' ' ' ILE . 24.0 ttp180 -54.91 -47.18 74.7 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 122.052 0.929 . . . . 0.0 108.509 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 90' ' ' ASP . . . . . 0.603 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.51 -45.37 93.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.27 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.54 79.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.689 0.222 . . . . 0.0 111.411 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.784 HG13 HD11 ' B' ' 26' ' ' LEU . 46.8 t -61.69 -41.54 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.603 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.0 OUTLIER -59.87 -58.47 8.42 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.545 177.915 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.7 -51.42 63.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.937 -1.028 . . . . 0.0 112.31 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.765 ' HG ' HD12 ' B' ' 99' ' ' LEU . 15.5 tp -62.04 -42.61 99.36 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.844 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.461 HD12 HG12 ' B' ' 92' ' ' VAL . 20.7 mt -68.89 -41.03 78.84 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -64.2 -23.45 67.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 122.094 0.95 . . . . 0.0 109.116 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -84.08 -50.82 7.6 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.237 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.765 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.3 mt -75.25 -49.86 17.95 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 113.47 -1.696 . . . . 0.0 115.103 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.682 HD22 ' HB ' ' B' ' 50' ' ' ILE . 54.6 mt -50.36 -58.41 9.89 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.608 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.9 Cg_exo -54.96 -20.71 23.96 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.19 1.927 . . . . 0.0 113.448 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -88.0 -6.79 57.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.764 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 . . . . . 0 C--N 1.331 -0.235 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.599 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.818 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 51.0 tt0 . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.636 ' HB3' ' HE2' ' A' ' 403' ' ' PHE . 3.5 m-20 -144.95 89.63 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.521 -177.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.507 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.0 -48.11 0.49 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -74.39 20.57 0.11 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.694 0.759 . . . . 0.0 111.18 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.655 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.4 OUTLIER -54.37 132.09 43.43 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.328 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 C--N 1.319 -0.719 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.963 -179.948 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.457 HG11 HG12 ' B' ' 11' ' ' ILE . 63.7 t . . . . . 0 N--CA 1.445 -0.707 0 CA-C-O 121.153 0.501 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.41 ' HB2' HD21 ' B' ' 95' ' ' LEU . 31.8 mt -81.3 -33.8 32.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.623 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.401 ' CD2' HG22 ' B' ' 92' ' ' VAL . 6.2 tp -132.11 128.63 38.55 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.457 HG12 HG11 ' B' ' 8' ' ' VAL . 66.3 mt -111.64 122.0 65.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.847 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.6 t -113.57 149.89 15.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.612 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -116.71 179.32 4.04 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.666 -178.391 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 18.21 66.87 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 O-C-N 125.356 1.66 . . . . 0.0 113.491 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.612 HG23 ' O ' ' B' ' 13' ' ' LYS . 14.9 t -115.05 123.67 70.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.482 179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 54.3 mtt85 -97.44 122.34 40.37 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.233 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.7 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 22.4 tm0? -104.84 102.31 11.86 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.7 mttt 51.53 61.52 3.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.735 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.77 12.82 1.39 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 177.457 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.74 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 7.0 pt20 -130.52 125.88 35.41 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.393 0.997 . . . . 0.0 111.007 178.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -80.33 152.74 28.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -177.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.419 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . 175.68 -159.17 26.76 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.948 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.23 137.53 52.91 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.944 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.21 140.25 35.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.729 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' TYR . . . . . 0.436 ' CD2' ' HE2' ' B' ' 41' ' ' PHE . 55.4 m-85 -134.83 122.9 22.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.878 HD11 HG13 ' B' ' 92' ' ' VAL . 15.8 mt -103.18 118.01 35.83 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.564 -0.455 . . . . 0.0 111.797 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -93.36 163.01 13.76 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.08 -21.98 60.07 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -115.25 -15.46 11.61 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ARG . . . . . 0.531 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -158.83 166.6 31.52 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 119.744 -0.782 . . . . 0.0 112.892 -177.007 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.863 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -110.23 122.46 64.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.912 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.471 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -124.14 152.81 42.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.085 0.469 . . . . 0.0 110.656 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.944 ' HB2' HD12 ' B' ' 24' ' ' LEU . 25.2 t90 -146.96 140.08 25.32 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -128.82 140.0 37.27 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.522 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.875 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 22.0 Cg_exo -64.02 158.48 47.39 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.625 2.217 . . . . 0.0 111.752 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.23 122.03 11.51 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.383 0.611 . . . . 0.0 111.967 -178.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.36 29.73 59.64 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.308 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.875 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.48 146.72 39.14 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.046 0.423 . . . . 0.0 110.295 178.837 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -92.91 -20.75 20.33 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.938 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -113.18 144.43 42.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.48 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.436 ' HE2' ' CD2' ' B' ' 25' ' ' TYR . 84.5 m-85 -85.74 122.43 29.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.727 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.82 -17.5 33.27 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.351 0.596 . . . . 0.0 110.278 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.707 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -112.64 119.86 61.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.153 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.0 t -148.0 101.45 3.29 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.479 ' CD2' HG23 ' B' ' 43' ' ' ILE . 61.6 m-70 -126.59 131.09 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.669 0.271 . . . . 0.0 110.282 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.531 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 67.8 mmm -83.36 143.12 30.54 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.646 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.87 -24.21 56.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.025 0.441 . . . . 0.0 110.571 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.16 -9.03 58.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.922 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.71 ' HA ' ' HE2' ' B' ' 70' ' ' HIS . 34.7 m-20 -109.92 -8.83 14.81 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.214 0.53 . . . . 0.0 110.039 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.556 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.0 OUTLIER -88.28 129.47 39.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.049 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.435 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 31.0 tttp -86.01 -38.72 17.6 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.657 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.3 p -167.24 178.81 5.39 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.513 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 53' ' ' GLN . . . . . 0.422 HE22 ' HG3' ' B' ' 93' ' ' LYS . 1.9 pp0? -142.41 135.82 28.91 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.416 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.006 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 34.0 mttm -105.79 155.5 19.23 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.001 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.541 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -128.12 129.99 69.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 176.453 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.42 122.37 63.05 Favored Pre-proline 0 C--O 1.25 1.107 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.661 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.21 172.89 11.3 Favored 'Trans proline' 0 C--O 1.235 0.342 1 C-N-CA 125.48 4.12 . . . . 0.0 114.657 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -65.14 160.41 21.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.824 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.42 -28.99 8.21 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.818 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 7.5 mttp -85.76 162.38 18.74 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.243 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.98 -17.73 60.49 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.114 0.483 . . . . 0.0 110.331 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.661 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 13.8 pttp -135.16 133.89 39.61 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.149 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.558 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.1 mp -79.58 129.91 36.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.544 ' OE1' ' HD3' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -133.13 163.68 28.73 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -175.11 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.524 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -139.37 153.02 47.59 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 112.963 -1.926 . . . . 0.0 106.432 176.106 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.006 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.1 135.33 22.82 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 119.405 1.002 . . . . 0.0 111.545 179.408 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.863 HD11 HD13 ' B' ' 31' ' ' ILE . 76.7 mt -93.72 99.18 11.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.477 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.657 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.2 t -85.11 105.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.476 HD22 HD13 ' B' ' 50' ' ' ILE . 4.3 mt -89.88 155.7 18.97 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.146 0.498 . . . . 0.0 112.08 -177.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.71 ' HE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -81.4 4.32 21.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.718 0.771 . . . . 0.0 109.002 177.972 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -86.27 -5.84 59.1 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.206 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.46 13.96 56.33 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.095 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -126.27 155.14 42.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.761 0.315 . . . . 0.0 110.848 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.585 HG22 ' HA ' ' B' ' 68' ' ' VAL . 10.0 p -127.37 131.23 50.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.521 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.557 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.84 98.75 8.38 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.787 0.327 . . . . 0.0 110.16 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.485 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.7 m-20 -86.29 147.95 25.84 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.096 0.474 . . . . 0.0 111.381 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.707 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 61.4 m-85 -131.9 116.57 17.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.691 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.541 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.9 t-160 -86.95 103.48 15.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.61 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.684 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 51.2 m-85 -76.5 96.91 4.19 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.96 19.53 20.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.44 ' HA ' HD22 ' B' ' 81' ' ' ASN . 1.0 OUTLIER -90.91 93.6 9.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.291 0.567 . . . . 0.0 109.589 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.76 -32.64 0.63 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.01 -59.47 2.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.526 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.5 p -127.39 10.86 6.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -176.099 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.684 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.39 -52.1 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.442 HG22 HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.75 -50.58 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.691 0.281 . . . . 0.0 111.221 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.526 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.7 mttt -67.53 -33.63 75.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.648 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.1 mt-10 -64.63 -44.41 90.59 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.558 ' HD3' HG23 ' B' ' 63' ' ' ILE . 20.7 ttp180 -56.43 -47.1 79.79 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.68 -41.9 99.34 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.757 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.8 -41.47 78.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.614 0.188 . . . . 0.0 111.243 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.878 HG13 HD11 ' B' ' 26' ' ' LEU . 38.6 t -62.4 -43.53 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.544 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.422 ' HG3' HE22 ' B' ' 53' ' ' GLN . 0.5 OUTLIER -58.06 -52.79 64.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.096 178.061 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -57.16 -53.49 57.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.605 -179.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.802 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.3 tp -63.61 -36.98 85.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.008 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.8 mt -70.42 -45.1 66.56 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 110.43 -0.211 . . . . 0.0 110.43 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -62.43 -21.27 65.28 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.007 0.908 . . . . 0.0 109.461 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.34 -47.41 9.39 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.194 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.802 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.2 mt -81.44 -46.29 14.79 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -176.7 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.646 HD23 ' HB3' ' B' ' 47' ' ' TYR . 38.3 mt -52.38 -58.19 12.62 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.007 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.619 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 59.2 Cg_exo -54.68 -19.85 19.84 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.325 2.016 . . . . 0.0 113.829 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -84.88 -21.19 29.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 0.0 111.346 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 C--N 1.327 -0.377 0 CA-C-O 120.659 0.266 . . . . 0.0 111.355 -179.471 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.88 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.5 tt0 . . . . . 0 CA--C 1.513 -0.452 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.733 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -136.37 89.52 2.48 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 -176.199 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.0 p-10 -139.31 -46.6 0.46 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -72.92 9.37 1.18 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.24 0.543 . . . . 0.0 110.846 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.673 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -50.25 120.26 4.37 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.033 179.812 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 C--N 1.32 -0.717 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.325 -178.905 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 42.9 t . . . . . 0 CA--C 1.52 -0.195 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.9 mt -91.09 -29.34 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.931 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.498 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -139.65 131.32 27.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 78.9 mt -115.05 122.68 69.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.859 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.7 t -114.33 150.34 16.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.647 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.7 mtmp? -114.8 177.22 4.73 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.488 -178.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.579 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.71 73.33 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 O-C-N 125.152 1.533 . . . . 0.0 113.343 -178.395 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.724 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.6 t -126.12 129.36 72.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.396 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.68 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 0.3 OUTLIER -99.6 145.19 27.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.053 0.454 . . . . 0.0 111.332 179.666 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.656 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -132.48 103.22 6.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.169 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.46 ' HG3' HE22 ' B' ' 17' ' ' GLN . 35.2 mttp 58.82 54.39 5.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.929 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? 72.19 23.99 3.22 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.898 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.68 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 36.9 mt-30 -126.29 119.63 27.88 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.559 ' HA ' ' HG3' ' B' ' 16' ' ' ARG . 0.8 OUTLIER -85.36 139.18 31.77 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.918 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -174.37 -151.06 8.07 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.753 -0.736 . . . . 0.0 113.589 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.3 140.18 52.38 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 122.73 0.412 . . . . 0.0 110.008 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.943 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -102.03 145.7 28.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.471 -178.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -139.33 112.77 8.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.735 0.303 . . . . 0.0 110.357 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.983 HD11 HG13 ' B' ' 92' ' ' VAL . 12.1 mt -90.27 137.23 32.51 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.13 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 27' ' ' MET . . . . . 0.532 ' HB3' ' NH2' ' B' ' 30' ' ' ARG . 42.8 mtt -120.8 167.19 12.77 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.028 -178.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.14 -49.76 8.89 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -122.75 11.59 9.76 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.458 -178.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ARG . . . . . 0.578 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.0 OUTLIER -159.6 156.4 27.92 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.253 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 1.024 HD13 HD11 ' B' ' 67' ' ' LEU . 1.5 tt -111.59 122.01 65.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -120.17 150.84 40.0 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.983 0.42 . . . . 0.0 110.775 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.943 ' HB2' HD12 ' B' ' 24' ' ' LEU . 48.2 t90 -146.99 141.2 26.19 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.868 ' HB1' ' HD3' ' B' ' 38' ' ' LYS . . . -139.6 129.46 14.11 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.56 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.918 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 21.1 Cg_endo -62.87 167.42 12.1 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.873 2.382 . . . . 0.0 112.489 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.54 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 72.4 mt-10 -81.65 124.0 29.19 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.479 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 118.36 -30.29 6.07 Favored Glycine 0 C--O 1.228 -0.281 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.766 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.868 ' HD3' ' HB1' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -75.14 171.73 13.64 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.499 0.666 . . . . 0.0 111.762 -179.943 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 39' ' ' ASP . . . . . 0.519 ' OD1' ' HG3' ' B' ' 40' ' ' ARG . 18.1 p-10 -115.74 -23.07 8.84 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.168 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.519 ' HG3' ' OD1' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -117.72 149.54 40.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.368 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.526 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 50.5 m-85 -70.32 154.61 41.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.576 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.8 p -115.48 -43.3 3.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.258 0.552 . . . . 0.0 109.801 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.656 HG13 ' HG3' ' B' ' 17' ' ' GLN . 18.6 mm -91.44 121.21 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.931 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 23.0 t -147.64 101.39 3.33 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.42 ' CD2' HG23 ' B' ' 43' ' ' ILE . 77.5 m-70 -125.94 138.78 53.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.919 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 78.8 mmm -88.85 143.75 26.68 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.569 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -58.12 -20.73 42.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.304 0.573 . . . . 0.0 109.802 178.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 48' ' ' ALA . . . . . 0.502 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -72.81 -18.52 61.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.81 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.63 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.79 -6.36 21.53 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 123.46 0.475 . . . . 0.0 110.232 -179.731 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.59 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.6 mm -90.37 130.58 39.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.441 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 31.8 tttp -91.06 -44.41 9.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.488 0.661 . . . . 0.0 110.427 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.625 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.2 p -158.25 -177.31 6.46 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.497 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 53' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' B' ' 96' ' ' LEU . 5.0 pt20 -145.3 148.77 33.8 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.793 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.087 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 42.2 mttm -117.03 154.11 31.5 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 176.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.696 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -130.22 128.72 64.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.801 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.6 p -88.81 119.8 69.99 Favored Pre-proline 0 C--O 1.249 1.042 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.155 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.76 173.54 13.79 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 125.255 3.97 . . . . 0.0 114.275 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -59.45 160.93 6.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.127 178.404 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.18 -29.25 7.79 Favored Glycine 0 C--N 1.317 -0.477 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -177.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.88 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.5 mttp -89.51 153.14 21.03 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.29 -3.36 16.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.249 0.547 . . . . 0.0 110.64 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.81 154.26 45.09 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.288 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.628 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -99.85 135.23 36.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -137.79 162.95 32.58 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.844 -1.142 . . . . 0.0 113.991 -177.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.644 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.4 tp -139.92 153.66 47.01 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.276 177.13 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.087 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -143.87 141.3 30.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.938 0.79 . . . . 0.0 111.278 178.742 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 1.024 HD11 HD13 ' B' ' 31' ' ' ILE . 64.7 mt -97.77 103.78 15.75 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.145 178.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.669 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.8 t -87.16 105.91 15.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.562 HD22 HD13 ' B' ' 50' ' ' ILE . 3.4 mt -91.18 158.1 16.81 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.012 -177.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.63 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.15 -1.68 45.47 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.162 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.76 -10.69 59.67 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.475 -1.238 . . . . 0.0 110.314 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.84 12.86 48.75 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.058 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -126.33 158.14 36.61 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.964 0.412 . . . . 0.0 110.929 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.669 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.9 p -128.59 131.6 48.17 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.6 m -104.37 105.34 15.44 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.359 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.733 HD21 ' HB3' ' A' ' 400' ' ' ASP . 5.0 m-20 -82.29 136.97 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.363 0.602 . . . . 0.0 111.956 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.422 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.1 m-85 -121.63 110.85 16.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.598 178.232 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.724 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.8 t60 -86.53 99.1 11.44 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.658 -1.155 . . . . 0.0 111.804 -177.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.644 ' HE1' ' HB2' ' B' ' 65' ' ' LEU . 71.6 m-85 -77.26 94.24 4.11 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 178.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.18 1.54 39.17 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.579 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -79.99 91.38 5.44 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.86 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.82 -39.68 2.59 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.6 -59.62 4.36 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.523 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.4 p -127.81 9.0 6.35 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -176.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.526 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.23 -50.71 6.4 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.4 -51.91 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.82 0.343 . . . . 0.0 110.811 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.523 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.3 mttt -66.6 -35.17 79.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.874 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.653 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -63.35 -46.54 86.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.104 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.636 ' HD2' HD12 ' B' ' 55' ' ' ILE . 22.2 ttp180 -55.73 -48.47 75.14 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 90' ' ' ASP . . . . . 0.536 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -61.56 -44.66 96.62 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.052 -1.431 . . . . 0.0 112.502 -179.627 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -43.19 76.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.89 0.314 . . . . 0.0 111.097 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.983 HG13 HD11 ' B' ' 26' ' ' LEU . 58.0 t -60.8 -43.57 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.696 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.2 tmmt? -60.37 -55.9 27.95 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.813 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -53.32 -55.39 25.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.891 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.766 ' HG ' HD12 ' B' ' 99' ' ' LEU . 14.0 tp -60.96 -41.25 95.99 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.96 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.509 HD12 HG12 ' B' ' 92' ' ' VAL . 27.1 mt -69.36 -42.79 74.77 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.392 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -66.0 -18.51 65.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.903 0.859 . . . . 0.0 109.368 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.02 -51.01 6.62 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.759 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.766 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -77.48 -48.15 17.83 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.451 -1.704 . . . . 0.0 115.019 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.59 HD22 ' HB ' ' B' ' 50' ' ' ILE . 19.0 mt -48.92 -56.29 16.07 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 19.6 Cg_endo -57.05 -15.33 17.21 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.27 1.98 . . . . 0.0 114.034 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.2 mttm -87.59 -20.51 26.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.502 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 26.7 m-85 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.514 ' HB3' ' HE2' ' B' ' 62' ' ' LYS . 7.2 tt0 . . . . . 0 CA--C 1.507 -0.685 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.898 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.6 OUTLIER -170.63 83.97 0.1 Allowed 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.929 -177.625 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.458 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.7 p-10 -138.52 -46.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 402' ' ' ASP . . . . . 0.491 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 2.6 p30 -72.8 7.25 2.06 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.498 0.666 . . . . 0.0 110.208 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 1.009 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -54.1 126.51 23.01 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.794 179.467 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 . . . . . 0 C--N 1.322 -0.606 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.016 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 79.7 t . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.4 mt -84.44 -29.54 26.01 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.728 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.492 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.32 125.56 29.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.9 mt -112.68 116.07 51.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.773 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -107.05 147.77 11.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.575 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -107.84 175.38 5.5 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.051 -178.54 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.657 ' HE2' ' HA ' ' B' ' 81' ' ' ASN . 29.3 mtpt 18.23 76.17 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 O-C-N 125.147 1.53 . . . . 0.0 113.552 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.575 HG23 ' O ' ' B' ' 13' ' ' LYS . 40.1 t -124.2 120.14 58.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.811 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.579 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 26.3 mtp180 -90.85 125.9 35.88 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.223 0.535 . . . . 0.0 111.032 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.429 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 2.8 tp-100 -117.21 112.18 20.47 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.891 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.1 OUTLIER 66.12 43.18 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.601 0.563 . . . . 0.0 110.639 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 70.59 19.28 6.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.472 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.499 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 46.1 tt0 -125.93 119.22 27.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.452 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.433 ' CG ' ' HG2' ' B' ' 16' ' ' ARG . 2.2 m-20 -68.68 153.74 43.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.037 0.446 . . . . 0.0 111.689 -179.257 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 178.43 -158.88 23.83 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.038 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 134.59 49.99 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.218 0.532 . . . . 0.0 110.62 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.938 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.33 139.73 32.85 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.509 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -135.94 108.52 7.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.584 0.23 . . . . 0.0 110.417 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.929 HD11 HG13 ' B' ' 92' ' ' VAL . 9.3 mt -86.84 125.65 34.12 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' MET . . . . . 0.628 ' HB2' ' HD2' ' B' ' 30' ' ' ARG . 5.4 mtm -106.69 173.67 6.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.921 0.391 . . . . 0.0 111.57 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.42 -52.9 7.39 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -118.22 8.03 12.23 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ARG . . . . . 0.628 ' HD2' ' HB2' ' B' ' 27' ' ' MET . 0.0 OUTLIER -158.7 151.0 21.55 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.95 -1.1 . . . . 0.0 112.666 -178.249 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.961 HD13 HD11 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -97.69 122.77 49.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.576 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -124.78 156.64 37.4 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.993 0.425 . . . . 0.0 110.828 -179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.938 ' HB2' HD12 ' B' ' 24' ' ' LEU . 39.1 t90 -147.12 132.72 18.78 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.453 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -114.7 136.25 22.44 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.105 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.871 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 24.0 Cg_exo -61.57 159.06 33.75 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.19 1.927 . . . . 0.0 111.062 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -62.47 134.54 56.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.308 0.575 . . . . 0.0 111.682 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 62.62 12.35 40.24 Favored Glycine 0 CA--C 1.521 0.414 0 CA-C-N 115.552 -0.749 . . . . 0.0 113.993 179.1 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.871 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 40.4 mttp -113.43 140.77 47.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.384 0.592 . . . . 0.0 110.807 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -85.18 -14.12 47.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.141 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.439 ' HG2' ' H ' ' B' ' 40' ' ' ARG . 2.2 ptp180 -106.13 129.9 54.12 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.188 0.518 . . . . 0.0 112.322 -178.01 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.442 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 45.3 m-85 -78.19 121.14 23.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.26 178.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 7.5 p -94.62 -7.72 40.1 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.642 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -119.95 118.65 57.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.306 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.2 t -148.01 101.61 3.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.823 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -124.13 137.22 54.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.465 ' O ' HG12 ' B' ' 50' ' ' ILE . 33.0 mtp -88.94 142.32 27.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.638 ' HB3' ' HA ' ' B' ' 100' ' ' LEU . 20.4 m-85 -57.5 -23.0 47.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.696 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.26 -27.21 65.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.938 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.564 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.15 -5.84 43.14 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.873 0.368 . . . . 0.0 111.147 -179.025 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.766 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -89.36 129.86 39.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.608 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 1.1 tttp -90.06 -41.39 11.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.201 0.524 . . . . 0.0 110.641 -178.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.608 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 4.7 p -163.79 -177.6 5.23 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.76 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' GLN . . . . . 0.664 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 5.5 pt20 -140.58 145.49 36.8 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.371 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.063 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 53.6 mttp -108.39 136.7 47.59 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.186 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.491 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -118.78 124.63 73.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 176.056 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.41 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -85.04 118.35 70.7 Favored Pre-proline 0 C--O 1.25 1.102 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -178.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 57' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 68.8 Cg_endo -68.88 173.24 10.46 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 125.117 3.878 . . . . 0.0 113.996 -178.249 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 160.5 5.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.482 -1.235 . . . . 0.0 109.885 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.13 7.91 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.491 ' HG3' ' OD2' ' A' ' 402' ' ' ASP . 5.6 mttp -86.82 153.79 21.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.57 -14.14 62.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.436 0.636 . . . . 0.0 109.944 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.514 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -137.69 141.79 41.08 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.557 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.508 HG21 ' HA ' ' B' ' 86' ' ' VAL . 3.8 mp -84.27 133.81 28.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -134.57 162.89 31.03 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 118.559 -1.256 . . . . 0.0 114.359 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.488 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.82 152.96 46.94 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 113.791 -1.55 . . . . 0.0 107.909 177.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.063 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.72 145.58 30.03 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.629 0.649 . . . . 0.0 110.48 177.94 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.961 HD11 HD13 ' B' ' 31' ' ' ILE . 96.1 mt -96.94 111.7 23.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.052 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.556 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.1 t -95.54 112.86 28.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.618 HD22 HD13 ' B' ' 50' ' ' ILE . 1.7 mt -97.43 158.46 15.46 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.564 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -80.21 -1.77 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.29 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.403 ' HB3' ' OD1' ' B' ' 73' ' ' ASP . . . -73.46 -16.68 61.3 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.67 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 103.02 8.66 41.4 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.899 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 73' ' ' ASP . . . . . 0.507 ' OD1' HD12 ' B' ' 69' ' ' LEU . 8.0 p-10 -126.42 172.24 10.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.199 0.523 . . . . 0.0 111.841 -179.148 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.556 HG22 ' HA ' ' B' ' 68' ' ' VAL . 30.4 p -137.58 143.57 41.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.574 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.554 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 16.7 m -116.82 109.38 17.02 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.504 0.322 . . . . 0.0 110.511 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.898 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.9 m-20 -82.31 154.46 25.3 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.38 0.61 . . . . 0.0 112.628 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.642 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.7 m-85 -141.5 104.01 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.834 -1.075 . . . . 0.0 108.834 178.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.579 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.2 t-160 -86.9 105.28 16.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.493 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.62 ' CE1' HG11 ' B' ' 12' ' ' VAL . 48.9 m-85 -76.71 101.61 5.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.3 p -95.62 7.27 46.75 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.949 0.404 . . . . 0.0 111.69 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.657 ' HA ' ' HE2' ' B' ' 14' ' ' LYS . 63.8 t30 -86.09 90.81 8.23 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -33.66 18.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 41.1 m -58.89 -59.96 4.62 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.486 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.78 13.15 6.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.513 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -46.52 -45.01 18.27 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.508 ' HA ' HG21 ' B' ' 63' ' ' ILE . 2.9 t -59.57 -54.72 30.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.006 0.432 . . . . 0.0 110.563 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.486 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.7 mptt -65.56 -36.76 84.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.192 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.686 ' O ' HG23 ' B' ' 92' ' ' VAL . 14.0 mt-10 -65.04 -43.56 91.97 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.498 ' HD3' HG23 ' B' ' 63' ' ' ILE . 23.9 ttp180 -56.6 -49.26 75.45 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.51 -42.75 97.06 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.368 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -44.1 78.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.822 0.283 . . . . 0.0 110.97 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.929 HG13 HD11 ' B' ' 26' ' ' LEU . 38.9 t -60.26 -43.63 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.664 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 2.9 ttpt -60.19 -53.42 57.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.138 178.49 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 94' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 2.1 m-20 -56.3 -51.25 68.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.879 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.722 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.7 tp -64.89 -37.39 87.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.719 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.413 HD12 HG12 ' B' ' 92' ' ' VAL . 27.9 mt -72.31 -47.59 48.72 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 121.308 -0.157 . . . . 0.0 111.06 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 97' ' ' GLN . . . . . 0.515 ' N ' HE22 ' B' ' 53' ' ' GLN . 13.5 pt20 -60.01 -21.66 61.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.193 0.997 . . . . 0.0 109.143 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.421 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 1.4 mm-40 -85.94 -47.83 9.26 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.135 -1.393 . . . . 0.0 111.363 178.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.722 HD12 ' HG ' ' B' ' 95' ' ' LEU . 13.6 mt -81.84 -38.69 25.09 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.256 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.766 HD22 ' HB ' ' B' ' 50' ' ' ILE . 30.2 mt -53.14 -62.66 3.18 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -66.51 -7.7 18.64 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.815 1.677 . . . . 0.0 113.36 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 12.4 mtmm -81.26 -31.87 33.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.784 0.326 . . . . 0.0 110.309 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 . . . . . 0 C--N 1.327 -0.411 0 CA-C-O 121.196 0.522 . . . . 0.0 110.614 179.854 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.89 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 65.1 tt0 . . . . . 0 CA--C 1.506 -0.724 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.612 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 2.4 m-20 -140.87 92.05 2.47 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.451 -175.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.521 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.4 OUTLIER -139.51 -48.39 0.47 Allowed 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -73.13 17.5 0.13 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.636 0.731 . . . . 0.0 111.229 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.921 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -55.64 128.74 36.09 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.878 179.124 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 . . . . . 0 C--N 1.317 -0.838 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.4 -179.142 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 70.2 t . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.682 ' HB2' HD21 ' B' ' 95' ' ' LEU . 23.0 mt -87.04 -28.9 22.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.158 -178.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.447 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -140.1 138.24 35.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.245 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 86.1 mt -121.75 126.47 74.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.699 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.0 t -118.25 148.24 21.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.638 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -110.62 -178.68 3.55 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.349 -179.358 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.494 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 47.8 mtpt 18.06 69.39 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 O-C-N 125.42 1.7 . . . . 0.0 113.559 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.638 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.5 t -119.17 123.35 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.558 179.115 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.639 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 13.8 mtp-105 -98.14 121.36 39.97 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.086 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 23.8 tm0? -105.63 103.29 12.77 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 50.9 mttt 52.81 62.87 2.47 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.761 0.663 . . . . 0.0 110.937 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? 68.43 24.61 7.13 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 113.088 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.639 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 20.5 mt-30 -129.84 119.31 23.13 Favored 'General case' 0 C--O 1.222 -0.375 0 O-C-N 122.23 -0.293 . . . . 0.0 111.275 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -75.08 145.04 42.64 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.149 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.33 -167.64 39.34 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.653 -0.784 . . . . 0.0 113.613 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.86 137.68 54.69 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.125 0.57 . . . . 0.0 109.803 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.928 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -100.54 140.82 34.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.232 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -135.62 124.67 24.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.844 HD11 HG13 ' B' ' 92' ' ' VAL . 16.0 mt -108.03 122.85 47.7 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.668 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -103.35 160.88 14.31 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.49 -22.24 54.36 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -105.96 -23.23 12.71 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' B' ' 45' ' ' HIS . 0.0 OUTLIER -160.38 172.72 16.78 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.692 -0.803 . . . . 0.0 112.879 -176.582 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.983 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -112.67 122.89 67.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.742 178.3 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.473 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -122.57 150.45 42.59 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.928 ' HB2' HD12 ' B' ' 24' ' ' LEU . 36.8 t90 -146.87 137.02 23.49 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -123.86 142.32 39.15 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.5 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.1 159.08 48.45 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.379 2.053 . . . . 0.0 111.167 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.12 137.37 57.98 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.379 -179.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.8 29.81 75.84 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.333 -0.849 . . . . 0.0 113.192 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.444 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 19.1 mmtm -113.7 151.82 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.057 0.429 . . . . 0.0 110.936 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -99.82 -12.76 19.62 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.866 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -123.49 146.41 48.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.059 0.457 . . . . 0.0 111.571 -178.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -87.06 121.64 29.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.002 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.4 p -85.84 -23.65 27.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.34 0.59 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.6 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 16.4 mm -103.42 118.74 50.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.018 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 33.4 t -147.83 101.45 3.31 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.502 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 68.9 m-70 -124.67 132.03 53.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.221 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.536 ' O ' HG12 ' B' ' 50' ' ' ILE . 81.1 mmm -81.85 143.32 31.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.343 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.468 ' CE1' HD13 ' B' ' 99' ' ' LEU . 22.3 m-30 -56.97 -24.08 50.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 110.608 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.22 -27.55 64.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.992 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.575 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -93.35 -7.16 45.57 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.021 0.438 . . . . 0.0 110.683 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.625 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.0 mm -87.88 130.64 37.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.863 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 1.5 ttpt -87.52 -37.58 16.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.298 0.571 . . . . 0.0 109.817 -179.215 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.863 ' SG ' ' HE2' ' B' ' 51' ' ' LYS . 21.8 p -171.89 -178.13 2.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.78 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -143.33 140.77 30.7 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.262 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.062 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.8 mttp -107.04 156.17 19.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.527 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.6 OUTLIER -131.56 131.57 62.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 176.227 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.11 120.77 66.66 Favored Pre-proline 0 C--O 1.252 1.209 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.174 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.59 172.75 12.85 Favored 'Trans proline' 0 C--O 1.233 0.246 1 C-N-CA 125.319 4.013 . . . . 0.0 114.57 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -64.04 160.48 17.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.158 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.72 -29.03 8.08 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -178.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.89 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.6 mttp -86.96 160.36 18.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.143 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.9 -9.86 59.63 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.401 0.62 . . . . 0.0 109.658 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.638 ' HD3' ' HB3' ' A' ' 399' ' ' GLU . 3.7 ptmt -134.5 129.82 35.73 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.194 -179.24 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.48 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -83.53 131.53 33.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 177.036 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.588 ' CG ' ' HE2' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -137.95 163.88 30.42 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -175.366 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.526 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.5 tp -139.63 153.46 47.33 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.046 -1.888 . . . . 0.0 106.842 176.271 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.062 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.3 138.02 24.81 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 119.254 0.934 . . . . 0.0 111.451 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.983 HD11 HD13 ' B' ' 31' ' ' ILE . 95.8 mt -94.01 100.54 12.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.923 179.126 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.703 ' HA ' HG22 ' B' ' 74' ' ' THR . 5.2 t -84.14 104.34 12.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.057 -0.719 . . . . 0.0 109.057 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.613 HD22 HD13 ' B' ' 50' ' ' ILE . 2.9 mt -91.36 158.67 16.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.913 0.387 . . . . 0.0 111.408 -178.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.575 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -81.25 -0.6 41.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.163 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.77 -9.29 58.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.582 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.08 9.7 56.85 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.0 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -126.4 151.58 47.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.927 0.394 . . . . 0.0 110.861 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.703 HG22 ' HA ' ' B' ' 68' ' ' VAL . 21.8 p -121.4 130.34 53.54 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.561 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.5 m -99.02 98.65 9.67 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.439 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.6 m-20 -83.9 143.39 29.9 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.102 0.477 . . . . 0.0 111.28 -178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.454 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 65.2 m-85 -128.85 112.8 14.51 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.131 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.565 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.2 t-160 -86.55 104.75 16.29 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.639 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.697 ' CE2' HG11 ' B' ' 12' ' ' VAL . 52.2 m-85 -76.45 94.32 3.65 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 5.8 p -99.28 12.82 35.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.494 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 40.3 t30 -85.09 91.94 8.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -45.93 -32.38 2.68 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.836 0.854 . . . . 0.0 112.928 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.26 -60.64 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.508 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -128.63 11.88 6.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 -176.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.659 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -42.94 -50.31 5.83 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -52.32 60.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.868 0.366 . . . . 0.0 110.91 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.508 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.45 -35.68 80.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.9 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.682 ' O ' HG23 ' B' ' 92' ' ' VAL . 14.3 mt-10 -64.75 -44.31 90.52 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.502 ' HD2' HD12 ' B' ' 55' ' ' ILE . 20.6 ttp180 -56.18 -48.64 75.97 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.6 -43.83 96.99 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.588 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.4 -42.23 83.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 117.713 0.233 . . . . 0.0 111.178 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.844 HG13 HD11 ' B' ' 26' ' ' LEU . 38.2 t -62.23 -43.85 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.434 ' HB2' HD11 ' B' ' 65' ' ' LEU . 0.6 OUTLIER -57.9 -53.98 52.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.992 178.118 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.7 -54.54 45.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.868 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.863 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.7 tp -62.08 -35.7 79.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.355 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.45 HD12 HG12 ' B' ' 92' ' ' VAL . 28.3 mt -74.41 -47.37 34.24 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 97' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' B' ' 97' ' ' GLN . 0.9 OUTLIER -60.29 -21.59 62.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.278 1.037 . . . . 0.0 109.136 178.682 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -87.03 -45.49 10.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.171 -1.377 . . . . 0.0 111.482 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.863 HD12 ' HG ' ' B' ' 95' ' ' LEU . 10.6 mt -85.0 -43.81 13.64 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -176.48 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.625 HD22 ' HB ' ' B' ' 50' ' ' ILE . 22.7 mt -51.21 -60.51 5.56 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -176.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -59.72 -5.76 3.83 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.496 2.131 . . . . 0.0 114.177 -177.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -85.65 -20.89 28.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.852 0.358 . . . . 0.0 110.486 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.455 179.433 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.952 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.1 tt0 . . . . . 0 CA--C 1.514 -0.427 0 CA-C-O 120.738 0.304 . . . . 0.0 111.548 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.516 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 6.9 p-10 -136.53 91.67 2.68 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.511 0.672 . . . . 0.0 111.725 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.495 ' C ' ' H ' ' A' ' 403' ' ' PHE . 26.3 p-10 -139.16 -47.4 0.48 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -71.92 9.33 0.95 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.515 0.674 . . . . 0.0 110.592 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.798 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -52.03 118.3 3.37 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 404' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' B' ' 54' ' ' LYS . 1.0 OUTLIER . . . . . 0 C--N 1.319 -0.739 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.509 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.523 HG11 HG12 ' B' ' 11' ' ' ILE . 74.3 t . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 120.905 0.383 . . . . 0.0 110.493 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.6 mt -88.86 -32.17 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.433 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.536 ' HB3' ' HB2' ' B' ' 26' ' ' LEU . 6.1 tp -129.87 123.52 31.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.59 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.523 HG12 HG11 ' B' ' 8' ' ' VAL . 56.5 mt -107.97 120.9 60.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.878 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.2 t -112.13 149.99 14.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.617 ' O ' HG23 ' B' ' 15' ' ' VAL . 2.0 mtmp? -115.9 -179.78 3.75 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.705 -178.185 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 18.15 63.51 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 O-C-N 125.214 1.571 . . . . 0.0 113.937 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.3 t -113.73 127.09 71.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 84.0 mtt180 -100.6 126.63 47.1 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.409 0.623 . . . . 0.0 111.619 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.497 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 5.6 tp-100 -105.84 103.39 12.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 0.6 OUTLIER 63.89 47.22 3.58 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.658 0.599 . . . . 0.0 110.16 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.4 OUTLIER 74.08 9.22 4.65 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.138 179.364 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.673 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.4 tp-100 -104.89 118.44 36.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.45 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 0.4 OUTLIER -72.11 147.5 46.63 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.328 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.578 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . 178.29 -160.68 26.96 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.904 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.4 136.21 50.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.965 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.32 139.11 33.76 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.298 -179.016 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 25' ' ' TYR . . . . . 0.404 ' CE1' HG23 ' B' ' 11' ' ' ILE . 75.7 m-85 -132.63 109.59 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.389 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 1.049 HD11 HG13 ' B' ' 92' ' ' VAL . 9.0 mt -87.46 125.22 34.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.836 0.35 . . . . 0.0 110.892 -179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 41.6 mtt -103.73 164.02 11.95 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.98 -39.18 71.45 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' GLU . . . . . 0.944 ' HA ' ' HZ ' ' B' ' 103' ' ' PHE . 25.9 mm-40 -113.02 1.49 15.38 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 30' ' ' ARG . . . . . 0.455 ' NH1' ' HB2' ' B' ' 29' ' ' GLU . 0.0 OUTLIER -161.76 154.61 20.43 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 119.522 -0.871 . . . . 0.0 112.76 -178.064 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.815 HD13 HD11 ' B' ' 67' ' ' LEU . 1.2 tt -102.81 118.13 49.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -118.56 152.2 36.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.398 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.965 ' HB2' HD12 ' B' ' 24' ' ' LEU . 38.1 t90 -147.09 134.71 21.01 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.451 ' HB2' ' CD2' ' B' ' 41' ' ' PHE . . . -120.96 129.61 25.22 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.78 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.641 ' HG2' ' HD3' ' B' ' 38' ' ' LYS . 47.4 Cg_endo -73.55 143.71 34.77 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.498 2.132 . . . . 0.0 111.7 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.557 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 63.2 mt-10 -61.64 131.2 49.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 0.0 110.856 -179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.65 -10.62 60.96 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.834 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.641 ' HD3' ' HG2' ' B' ' 35' ' ' PRO . 5.8 mptt -113.65 152.51 30.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -100.9 -18.5 16.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.68 127.91 53.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.008 0.432 . . . . 0.0 111.816 -178.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.451 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 44.6 m-85 -63.95 121.09 13.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.56 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.38 -34.23 23.62 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.984 0.421 . . . . 0.0 110.843 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.829 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 24.2 mm -93.43 122.69 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.909 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 35.8 t -147.95 101.2 3.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.403 ' CD2' HG23 ' B' ' 43' ' ' ILE . 79.9 m-70 -127.43 140.51 52.12 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.491 ' O ' HG12 ' B' ' 50' ' ' ILE . 27.8 mtp -91.82 144.88 25.04 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.746 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.5 m-30 -60.29 -19.8 56.49 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.838 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.92 -21.53 63.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.379 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.533 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -101.51 -11.28 19.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.001 0.429 . . . . 0.0 110.6 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.751 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.5 mm -88.68 125.89 41.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.642 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 9.3 tmtt? -86.18 -38.04 18.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.03 0.443 . . . . 0.0 109.919 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.642 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 28.3 p -169.55 -177.81 2.86 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.402 -0.817 . . . . 0.0 108.917 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.11 141.94 46.12 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.751 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.064 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 26.9 mttp -102.62 146.7 27.79 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.507 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.569 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.77 126.82 69.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.174 -1.046 . . . . 0.0 108.174 177.247 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.449 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.56 118.5 69.09 Favored Pre-proline 0 C--O 1.249 1.062 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.76 173.03 10.65 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 125.079 3.853 . . . . 0.0 114.624 -177.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -61.69 160.51 11.5 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.395 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.02 8.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 109.606 -1.397 . . . . 0.0 109.606 -177.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.952 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 12.8 mttp -87.75 152.66 21.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.06 -11.11 60.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.212 0.529 . . . . 0.0 110.544 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.487 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.95 138.0 35.21 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.661 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.533 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -83.3 140.55 16.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 177.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.449 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 86.8 mt-30 -139.98 162.86 34.19 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 118.529 -1.269 . . . . 0.0 114.081 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -142.38 153.81 44.09 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.58 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.064 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.37 144.83 30.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 118.978 0.808 . . . . 0.0 110.328 178.025 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.815 HD11 HD13 ' B' ' 31' ' ' ILE . 96.7 mt -94.06 104.51 16.54 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.229 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.616 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 45.0 t -88.92 120.36 37.5 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.487 HD12 ' HB3' ' B' ' 73' ' ' ASP . 9.4 mt -101.93 151.78 21.71 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.112 0.482 . . . . 0.0 111.791 -177.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.533 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.2 -7.55 54.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.611 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.3 -4.79 46.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.425 -1.262 . . . . 0.0 110.875 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.73 21.53 46.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 73' ' ' ASP . . . . . 0.487 ' HB3' HD12 ' B' ' 69' ' ' LEU . 20.1 t70 -126.02 160.92 28.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.446 -0.377 . . . . 0.0 110.222 -179.147 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.594 HG22 ' HA ' ' B' ' 68' ' ' VAL . 12.0 p -142.68 131.48 22.79 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.571 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 19.9 m -110.77 107.07 16.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.266 0.226 . . . . 0.0 110.434 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.29 151.18 26.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.517 . . . . 0.0 112.318 -178.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.829 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 35.9 m-85 -134.93 115.53 13.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.606 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.63 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.0 t-160 -87.35 100.91 13.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.887 -179.007 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.703 ' HZ ' HG21 ' B' ' 92' ' ' VAL . 22.9 m-85 -77.12 102.13 6.43 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.76 22.19 15.67 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.862 0.689 . . . . 0.0 112.862 -178.201 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.437 HD22 ' HA ' ' B' ' 81' ' ' ASN . 1.2 t-20 -89.45 97.06 10.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 110.292 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.09 -30.29 2.68 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.544 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.42 -59.53 2.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -178.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.482 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.0 p -127.38 11.05 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -175.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.643 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -45.63 -45.67 14.06 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.417 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.475 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.3 t -59.88 -52.67 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.803 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -67.52 -34.52 77.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.038 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.666 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.1 mt-10 -65.06 -45.61 84.59 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.569 ' HD2' ' HB ' ' B' ' 55' ' ' ILE . 24.7 ttp180 -54.06 -47.79 71.27 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 122.21 1.005 . . . . 0.0 108.398 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.27 -44.98 93.59 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.514 -1.675 . . . . 0.0 112.6 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.67 90.91 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.74 0.245 . . . . 0.0 111.154 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 1.049 HG13 HD11 ' B' ' 26' ' ' LEU . 42.9 t -60.87 -44.89 98.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -57.93 -54.65 44.51 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.063 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 94' ' ' ASP . . . . . 0.473 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 1.6 m-20 -55.37 -52.16 64.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.494 -1.23 . . . . 0.0 112.525 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.823 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -65.23 -28.42 69.35 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.822 -178.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 35.5 mt -78.47 -45.74 21.38 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.377 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 97' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' B' ' 94' ' ' ASP . 2.5 pt20 -63.14 -18.24 63.22 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.249 1.023 . . . . 0.0 109.156 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -88.47 -47.96 7.96 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.927 -1.488 . . . . 0.0 111.057 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.823 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -83.62 -41.31 17.97 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.751 HD22 ' HB ' ' B' ' 50' ' ' ILE . 35.7 mt -51.96 -50.85 76.01 Favored Pre-proline 0 CA--C 1.54 0.596 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.441 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 21.6 Cg_exo -66.08 -23.09 53.82 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.182 1.921 . . . . 0.0 115.146 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 11.0 pttp -72.49 1.81 7.41 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.941 -0.475 . . . . 0.0 112.096 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.944 ' HZ ' ' HA ' ' B' ' 29' ' ' GLU . 30.2 m-85 . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.384 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.539 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 3.8 pt-20 . . . . . 0 CA--C 1.515 -0.401 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.831 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -132.77 83.91 2.1 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.758 -178.612 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.493 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.7 p-10 -138.23 -47.37 0.52 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -73.81 12.28 0.7 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.513 0.673 . . . . 0.0 110.442 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.826 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -53.78 122.13 9.31 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.884 179.44 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.502 -0.898 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.0 mt -96.0 -30.39 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.092 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.463 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -132.92 122.73 24.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 80.3 mt -109.13 118.36 56.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.74 HG11 ' HE2' ' B' ' 79' ' ' PHE . 2.6 t -112.22 147.79 15.77 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.648 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.0 OUTLIER -109.22 -177.65 3.35 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 18.97 74.29 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 O-C-N 125.388 1.68 . . . . 0.0 112.883 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.648 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.8 t -124.44 122.59 64.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.314 179.18 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.627 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 7.3 mtp180 -96.25 130.98 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.353 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.613 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 0.7 OUTLIER -121.42 103.38 8.9 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.612 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp 59.15 64.89 1.29 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.179 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 68.93 22.89 6.9 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 176.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.655 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.9 pt20 -145.69 132.64 20.21 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.995 0.816 . . . . 0.0 110.858 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.41 ' CA ' ' HG2' ' B' ' 16' ' ' ARG . 1.6 t70 -86.23 153.76 21.78 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.839 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.07 -156.34 17.09 Favored Glycine 0 CA--C 1.522 0.516 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.756 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.31 135.11 54.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.882 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -100.69 140.85 34.38 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.481 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -135.96 109.83 8.17 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.817 0.342 . . . . 0.0 110.236 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.956 HD11 HG13 ' B' ' 92' ' ' VAL . 10.6 mt -89.0 120.84 30.78 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.53 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 36.5 mtt -102.24 161.56 13.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.043 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -28.82 57.86 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.927 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.92 -16.9 13.43 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ptp85 -158.91 162.01 36.84 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.796 -0.761 . . . . 0.0 112.822 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.898 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.07 114.81 41.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.741 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -113.56 150.36 33.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.976 0.417 . . . . 0.0 110.836 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.882 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.9 t90 -147.56 141.71 26.11 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.007 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -128.6 136.94 29.9 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.257 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.692 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 20.0 Cg_exo -64.75 158.22 51.83 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.566 2.177 . . . . 0.0 112.104 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -56.17 121.61 9.85 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.413 0.625 . . . . 0.0 112.099 -178.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.05 29.77 68.53 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.266 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.692 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.64 136.47 52.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.034 0.417 . . . . 0.0 110.358 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.4 -16.51 42.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.372 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -109.64 138.21 46.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.689 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -82.97 120.39 25.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.3 p -96.88 -6.49 35.71 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.089 0.471 . . . . 0.0 110.957 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.614 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 11.1 mm -119.88 117.32 53.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.079 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.6 t -147.9 101.33 3.29 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.438 ' CD2' HG23 ' B' ' 43' ' ' ILE . 69.9 m-70 -122.13 128.99 51.94 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.463 ' O ' HG12 ' B' ' 50' ' ' ILE . 65.4 mmm -80.04 141.11 36.18 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.574 ' HB3' ' HA ' ' B' ' 100' ' ' LEU . 23.1 m-85 -56.15 -24.77 43.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.941 0.4 . . . . 0.0 110.95 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.65 -29.18 65.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.121 -179.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.602 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -89.8 -4.82 57.44 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.188 0.518 . . . . 0.0 110.592 -179.041 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.569 HD13 HD22 ' B' ' 69' ' ' LEU . 4.4 mm -88.34 128.86 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.459 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -85.39 -43.73 13.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.558 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.613 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 6.7 p -161.6 -177.82 6.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.733 -178.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -142.22 143.59 32.96 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.963 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.041 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 27.6 mttp -112.92 153.44 27.98 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.299 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.599 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -132.2 125.48 54.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.691 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -89.41 115.53 64.0 Favored Pre-proline 0 C--O 1.249 1.051 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.28 172.57 7.42 Favored 'Trans proline' 0 CA--C 1.518 -0.297 0 C-N-CA 125.155 3.903 . . . . 0.0 114.68 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.68 158.87 17.35 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.441 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.58 -29.16 8.04 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 109.841 -1.303 . . . . 0.0 109.841 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.539 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 4.2 mttm -82.36 156.26 24.32 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 176.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.19 -18.5 61.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.64 0.733 . . . . 0.0 109.271 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.401 ' HB2' ' CD2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -134.41 119.63 18.81 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.104 -179.518 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.514 HG12 HG22 ' B' ' 86' ' ' VAL . 3.1 mp -72.74 134.57 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.474 HE21 ' HB2' ' B' ' 64' ' ' GLN . 11.0 mt-30 -137.5 163.32 31.43 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -176.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.484 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -138.11 153.15 49.28 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 175.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.041 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -144.96 138.49 26.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 119.505 1.048 . . . . 0.0 111.478 179.043 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.898 HD11 HD13 ' B' ' 31' ' ' ILE . 94.7 mt -94.21 105.96 17.94 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.853 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.613 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -91.54 111.78 24.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.569 HD22 HD13 ' B' ' 50' ' ' ILE . 2.3 mt -100.34 158.65 15.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -176.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.602 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -77.49 -6.98 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.208 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.87 -7.79 52.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.727 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.4 15.04 57.81 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.814 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -126.22 155.46 41.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.996 0.427 . . . . 0.0 110.954 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.558 HG22 ' HA ' ' B' ' 68' ' ' VAL . 24.3 p -129.96 131.46 45.96 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.009 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.544 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 4.3 m -105.82 105.08 14.95 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.485 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.831 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.6 m-20 -82.09 137.65 34.98 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.548 0.689 . . . . 0.0 111.811 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.612 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.3 m-85 -125.57 102.5 7.4 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 114.653 -1.158 . . . . 0.0 108.724 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.627 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.4 t-160 -86.84 117.13 25.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.206 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.74 ' HE2' HG11 ' B' ' 12' ' ' VAL . 70.7 m-85 -83.28 94.84 8.0 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.46 1.05 54.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' B' ' 85' ' ' ALA . 0.2 OUTLIER -78.17 91.08 4.3 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.038 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.57 -35.4 3.94 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 19.3 m -60.7 -60.71 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 17.9 p -128.23 15.73 6.69 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.474 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.68 -46.3 7.36 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.651 HG12 ' HD2' ' B' ' 87' ' ' LYS . 24.3 t -58.32 -53.09 51.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 0.0 111.574 -179.475 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.651 ' HD2' HG12 ' B' ' 86' ' ' VAL . 0.0 OUTLIER -75.7 -25.15 56.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.623 -178.921 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.607 ' O ' HG23 ' B' ' 92' ' ' VAL . 16.0 mt-10 -67.26 -40.32 86.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 176.554 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.532 ' NE ' HD12 ' B' ' 55' ' ' ILE . 18.5 ttp180 -59.44 -45.89 90.29 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 90' ' ' ASP . . . . . 0.639 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 83.6 m-20 -58.69 -48.34 81.42 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.78 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.09 -42.03 94.45 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.956 HG13 HD11 ' B' ' 26' ' ' LEU . 60.9 t -62.02 -43.39 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.639 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 11.1 ttpp -58.92 -51.93 67.93 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.942 177.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -58.75 -54.31 48.5 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.889 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.74 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.5 tp -59.61 -38.85 82.37 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.705 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.76 -42.67 70.15 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -62.7 -24.3 67.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 122.383 1.087 . . . . 0.0 109.008 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -85.9 -47.94 9.19 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.934 -1.485 . . . . 0.0 111.425 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.74 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -80.78 -43.02 20.79 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 115.189 1.552 . . . . 0.0 115.189 -176.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.642 ' HB2' ' HD3' ' B' ' 101' ' ' PRO . 24.7 mt -51.14 -59.89 6.76 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.642 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 29.6 Cg_exo -62.73 -16.07 50.75 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.012 1.808 . . . . 0.0 113.251 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.5 mtmm -78.69 -15.56 58.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 110.281 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 . . . . . 0 C--N 1.327 -0.402 0 CA-C-O 121.476 0.655 . . . . 0.0 109.548 179.177 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.534 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.515 -0.373 0 CA-C-O 120.788 0.327 . . . . 0.0 110.572 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.445 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 0.6 OUTLIER -141.14 83.27 1.87 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.267 -179.345 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.556 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.2 p-10 -138.25 -46.67 0.52 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 402' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' B' ' 60' ' ' LYS . 2.3 p30 -72.97 11.58 0.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 122.047 0.927 . . . . 0.0 110.017 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.907 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -60.51 115.77 3.83 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.514 179.062 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 116.741 -0.208 . . . . 0.0 111.554 -178.532 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 62.9 t . . . . . 0 CA--C 1.516 -0.331 0 CA-C-O 121.094 0.473 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 27.9 mt -97.48 -31.83 12.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.93 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.2 tp -129.27 120.0 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.866 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.407 HG23 ' CE2' ' B' ' 25' ' ' TYR . 70.0 mt -103.9 120.93 54.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.939 -0.764 . . . . 0.0 108.939 177.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.833 HG21 HD23 ' B' ' 24' ' ' LEU . 3.3 t -111.27 149.31 14.06 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.383 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.576 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -113.86 179.32 3.99 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.543 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.499 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.48 72.04 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 O-C-N 125.328 1.642 . . . . 0.0 113.22 -178.155 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.576 HG23 ' O ' ' B' ' 13' ' ' LYS . 47.6 t -117.32 124.4 72.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.907 -1.042 . . . . 0.0 108.969 178.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.618 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.2 mtp180 -97.02 129.19 44.51 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.383 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.29 103.64 8.34 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.881 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.98 45.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.243 0 O-C-N 123.767 0.667 . . . . 0.0 110.65 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.423 ' HA ' ' CZ ' ' B' ' 16' ' ' ARG . 0.0 OUTLIER 67.13 23.4 9.58 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.792 179.59 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 2.9 tp-100 -123.67 119.43 29.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.605 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.78 153.32 27.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.189 0.519 . . . . 0.0 112.349 -177.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.02 -154.49 13.02 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.602 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.45 132.1 48.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.917 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.49 141.69 30.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 25' ' ' TYR . . . . . 0.407 ' CE2' HG23 ' B' ' 11' ' ' ILE . 37.4 m-85 -135.23 120.33 18.79 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.963 HD11 HG13 ' B' ' 92' ' ' VAL . 14.5 mt -99.94 116.24 31.53 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.03 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.8 mpt? -92.92 163.48 13.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.657 178.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.78 -39.9 62.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 58.5 mp0 -110.48 -5.04 15.23 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 30' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' B' ' 30' ' ' ARG . 14.4 ptt-85 -161.09 158.76 28.23 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.394 -0.922 . . . . 0.0 112.587 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.938 HD13 HD11 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.83 128.98 59.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.126 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.455 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -129.91 153.6 48.17 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.9 0.381 . . . . 0.0 110.509 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.917 ' HB2' HD12 ' B' ' 24' ' ' LEU . 36.5 t90 -147.01 141.8 26.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.451 ' HB2' ' HA ' ' B' ' 41' ' ' PHE . . . -128.25 143.91 49.81 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.866 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 34' ' ' ALA . 17.3 Cg_exo -65.48 153.01 80.14 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.699 2.266 . . . . 0.0 111.354 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -65.32 116.11 6.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.963 0.411 . . . . 0.0 110.21 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.25 8.75 54.75 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.301 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.905 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -105.04 144.8 31.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.689 0.757 . . . . 0.0 111.57 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.02 -22.31 27.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.172 -1.376 . . . . 0.0 111.523 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -122.13 150.29 42.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 0.0 111.611 -178.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.451 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 16.0 m-85 -79.9 143.4 34.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.17 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.1 -25.31 13.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.141 0.496 . . . . 0.0 110.476 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.838 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 16.3 mm -104.01 124.95 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.385 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.6 t -148.14 101.73 3.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.502 ' CD2' HG23 ' B' ' 43' ' ' ILE . 60.2 m-70 -130.25 138.43 50.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.528 ' O ' HG12 ' B' ' 50' ' ' ILE . 30.6 mtp -90.83 145.28 24.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.276 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.635 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.0 m-85 -57.84 -24.1 55.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.667 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.63 -26.2 64.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.876 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.54 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.96 -7.48 36.41 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.993 0.425 . . . . 0.0 110.735 -179.436 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.693 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -86.9 127.44 40.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.472 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 0.2 OUTLIER -81.38 -40.38 23.57 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.178 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.537 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 31.8 p -173.28 -177.84 1.6 Allowed 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.459 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 53' ' ' GLN . . . . . 0.571 HE22 HD11 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -137.71 139.34 40.11 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.909 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.058 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -102.76 151.4 22.44 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.573 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -128.03 128.98 69.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 175.897 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.414 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -90.05 114.08 59.56 Favored Pre-proline 0 C--O 1.249 1.068 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 57' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 64.4 Cg_endo -68.67 172.94 10.71 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 125.103 3.869 . . . . 0.0 114.492 -177.301 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -58.98 157.86 9.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.035 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.32 -29.03 8.21 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.534 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 4.1 mttm -85.28 160.09 19.92 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.1 -13.35 59.35 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.695 ' HB3' ' CD2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -131.72 127.75 37.49 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.568 -179.329 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.598 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -78.11 125.0 37.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 176.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -133.44 163.58 29.05 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -175.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.612 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -140.56 153.32 46.08 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 113.659 -1.609 . . . . 0.0 107.52 176.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.058 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.62 145.48 30.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 119.273 0.942 . . . . 0.0 111.141 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.938 HD11 HD13 ' B' ' 31' ' ' ILE . 73.1 mt -96.27 106.22 18.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.026 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.581 ' HA ' HG22 ' B' ' 74' ' ' THR . 10.6 t -93.25 121.87 44.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.491 HD22 HD13 ' B' ' 50' ' ' ILE . 4.3 mt -108.36 154.35 21.96 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -177.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.54 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.34 -5.73 46.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.747 0.784 . . . . 0.0 108.94 178.274 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.43 -4.11 43.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.559 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.57 21.04 55.19 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.371 -0.692 . . . . 0.0 111.371 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.05 157.3 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.514 -0.343 . . . . 0.0 110.533 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.581 HG22 ' HA ' ' B' ' 68' ' ' VAL . 19.8 p -139.86 131.03 26.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.548 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.3 102.68 11.78 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.464 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -82.36 139.14 34.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.338 0.589 . . . . 0.0 111.637 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.838 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 53.5 m-85 -129.53 110.92 12.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.012 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.695 ' CD2' ' HB3' ' B' ' 62' ' ' LYS . 5.3 t-160 -87.51 121.24 29.7 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.01 179.574 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.727 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 42.4 m-85 -85.03 93.6 8.63 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.5 13.68 25.22 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.499 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.0 OUTLIER -86.08 94.27 9.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.316 0.579 . . . . 0.0 110.513 179.47 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.74 -31.05 1.81 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.05 -59.52 2.7 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -178.191 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.509 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.3 p -127.32 14.16 7.16 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -176.221 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -45.36 -49.66 12.83 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 t -59.14 -51.4 73.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 110.876 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.509 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.6 mttt -66.38 -34.53 78.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.054 0.454 . . . . 0.0 109.979 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.613 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -65.84 -44.81 84.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.598 ' HD3' HG23 ' B' ' 63' ' ' ILE . 23.1 ttp180 -55.61 -45.33 77.51 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 90' ' ' ASP . . . . . 0.733 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -63.56 -45.79 88.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.733 -1.576 . . . . 0.0 112.519 179.676 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.22 81.85 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.924 0.329 . . . . 0.0 111.421 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.963 HG13 HD11 ' B' ' 26' ' ' LEU . 45.3 t -62.79 -39.38 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.733 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.6 OUTLIER -62.17 -56.89 14.18 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.563 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 94' ' ' ASP . . . . . 0.4 ' O ' ' HG2' ' B' ' 98' ' ' GLN . 1.6 m-20 -54.09 -53.89 46.93 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.801 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.732 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -61.64 -39.42 91.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.202 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.7 mt -69.47 -45.17 69.63 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 117.946 0.339 . . . . 0.0 110.366 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -64.24 -18.63 64.73 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.851 0.834 . . . . 0.0 109.475 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 98' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' B' ' 94' ' ' ASP . 27.9 mm-40 -85.88 -51.36 6.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.901 178.264 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.732 HD12 ' HG ' ' B' ' 95' ' ' LEU . 15.2 mt -76.0 -46.76 27.85 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.415 -1.721 . . . . 0.0 115.361 -176.473 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.693 HD22 ' HB ' ' B' ' 50' ' ' ILE . 31.5 mt -50.39 -60.15 5.85 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -61.74 -14.48 36.47 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.008 1.805 . . . . 0.0 113.146 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 20.3 mtmm -86.97 -14.51 41.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.17 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 . . . . . 0 C--N 1.331 -0.218 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.47 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.989 ' HG2' ' HE2' ' B' ' 62' ' ' LYS . 3.9 pt-20 . . . . . 0 CA--C 1.518 -0.276 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.906 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -143.55 84.53 1.8 Allowed 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.132 -0.627 . . . . 0.0 112.537 -177.244 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.519 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.7 p-10 -139.15 -45.67 0.47 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -72.37 11.06 0.65 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 110.271 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.923 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.02 112.55 1.55 Allowed 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.414 179.24 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 . . . . . 0 C--N 1.32 -0.71 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.411 -177.856 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 88.5 t . . . . . 0 CA--C 1.516 -0.336 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.533 HD12 HD11 ' B' ' 99' ' ' LEU . 22.7 mt -95.29 -29.01 14.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.264 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.454 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -137.4 137.3 38.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.055 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 75.5 mt -122.85 115.96 47.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.716 HG21 HD23 ' B' ' 24' ' ' LEU . 3.0 t -104.93 149.25 8.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.09 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.535 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.08 173.21 6.42 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.57 -179.177 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.59 ' HE3' ' HA ' ' B' ' 81' ' ' ASN . 22.1 mtmt 18.23 82.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 125.341 1.651 . . . . 0.0 113.471 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.535 HG23 ' O ' ' B' ' 13' ' ' LYS . 31.6 t -129.02 123.6 59.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.186 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.634 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 6.8 mtp-105 -98.61 141.27 31.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.213 0.53 . . . . 0.0 112.22 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -132.5 103.43 6.17 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 177.096 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 59.4 mttp 65.09 56.54 1.02 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.026 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? 68.83 23.93 6.69 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.155 177.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.554 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 63.5 tt0 -135.83 119.72 17.41 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.65 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -81.94 153.15 26.42 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.821 0.344 . . . . 0.0 111.72 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.672 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -177.38 -158.36 20.33 Favored Glycine 0 CA--C 1.521 0.433 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.186 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.42 136.83 54.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.126 0.488 . . . . 0.0 110.648 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.946 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.3 139.7 35.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.128 -178.449 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.45 125.72 29.63 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.899 HD11 HG13 ' B' ' 92' ' ' VAL . 16.9 mt -107.94 117.34 33.87 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.476 -0.489 . . . . 0.0 111.128 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -97.49 159.68 14.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.14 -27.83 55.64 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.101 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' GLU . . . . . 0.976 ' HA ' ' HE2' ' B' ' 103' ' ' PHE . 0.9 OUTLIER -103.07 -25.12 13.53 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.13 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 30' ' ' ARG . . . . . 0.492 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -157.97 169.86 23.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.915 -175.989 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.916 HD13 HD11 ' B' ' 67' ' ' LEU . 1.5 tt -110.79 122.14 64.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.661 178.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.459 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -123.17 149.82 44.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.011 0.434 . . . . 0.0 110.599 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.946 ' HB2' HD12 ' B' ' 24' ' ' LEU . 39.7 t90 -146.68 134.07 20.75 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.466 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -122.92 131.46 24.36 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.334 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.672 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 9.3 Cg_exo -70.3 160.0 51.08 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.536 2.157 . . . . 0.0 111.353 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 145.26 55.78 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.918 0.39 . . . . 0.0 109.972 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.35 24.87 74.93 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.555 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' B' ' 38' ' ' LYS . 25.3 mmtm -114.19 153.36 29.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.587 0.232 . . . . 0.0 110.579 179.101 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -106.39 5.02 29.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.556 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -151.73 160.18 43.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.24 -179.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -86.1 125.71 33.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.083 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 3.0 p -90.64 -22.48 21.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.29 0.567 . . . . 0.0 110.328 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.638 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 17.8 mm -107.46 118.62 55.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.111 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -147.93 101.58 3.31 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.477 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 59.1 m-70 -127.74 134.87 49.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.281 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.494 ' O ' HG12 ' B' ' 50' ' ' ILE . 84.0 mmm -84.79 143.07 29.35 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.708 ' HB2' ' HD2' ' B' ' 103' ' ' PHE . 22.7 m-30 -57.28 -22.69 43.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.83 0.348 . . . . 0.0 111.294 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.19 -26.87 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.893 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.617 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.6 OUTLIER -94.28 -4.21 49.19 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 110.6 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.619 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.7 mm -90.35 128.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.46 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 51.4 tttp -85.43 -40.68 16.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.396 0.617 . . . . 0.0 109.452 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.592 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.8 p -168.59 -177.62 3.18 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.291 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -143.06 139.57 30.56 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.313 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.942 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 53.2 mttp -106.99 161.44 14.72 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.668 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -133.07 130.15 57.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 175.982 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -91.27 118.0 68.2 Favored Pre-proline 0 C--O 1.25 1.086 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.66 173.08 11.4 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 124.966 3.778 . . . . 0.0 114.011 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -59.95 160.84 7.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.161 178.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.23 -28.76 8.09 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -177.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.553 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 14.5 mttp -89.52 158.29 17.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 176.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.96 -5.71 42.95 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.241 0.543 . . . . 0.0 110.485 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.989 ' HE2' ' HG2' ' A' ' 399' ' ' GLU . 0.7 OUTLIER -142.78 146.69 34.49 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.049 -179.558 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.697 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -90.61 131.47 37.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.53 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 24.5 mt-30 -131.9 163.16 28.93 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.526 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -140.82 153.45 45.8 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.417 -1.719 . . . . 0.0 106.642 175.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 0.942 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.47 142.39 28.05 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 119.149 0.886 . . . . 0.0 111.875 179.135 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.916 HD11 HD13 ' B' ' 31' ' ' ILE . 89.6 mt -94.33 104.49 16.47 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.928 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.664 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.1 t -90.14 114.39 27.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.548 HD22 HD13 ' B' ' 50' ' ' ILE . 4.0 mt -100.75 155.64 17.8 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -177.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.617 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -77.69 -3.46 41.23 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.279 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.94 -7.33 56.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.259 179.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.04 17.59 50.49 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.866 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -126.25 160.29 30.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.698 0.285 . . . . 0.0 110.8 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.664 HG22 ' HA ' ' B' ' 68' ' ' VAL . 21.2 p -137.71 131.73 31.79 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.552 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.4 m -106.48 109.57 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.41 0.148 . . . . 0.0 111.302 -179.555 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.906 HD21 ' HB3' ' A' ' 400' ' ' ASP . 5.6 m-20 -82.29 147.29 28.97 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.742 0.782 . . . . 0.0 112.19 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.638 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 43.1 m-85 -134.51 103.5 5.71 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.743 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.634 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.6 t-160 -86.46 107.78 18.22 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.513 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.672 ' CE2' HG11 ' B' ' 12' ' ' VAL . 54.2 m-85 -76.26 94.37 3.55 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.158 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.04 5.16 47.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.891 -178.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.59 ' HA ' ' HE3' ' B' ' 14' ' ' LYS . 46.4 t30 -85.98 91.13 8.29 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.448 ' CD ' ' H ' ' B' ' 82' ' ' GLU . 0.7 OUTLIER -51.66 -29.09 16.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.543 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 2.1 m -60.13 -60.21 4.18 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.512 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.9 p -128.34 12.76 6.54 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.127 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.55 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.7 -50.04 7.68 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.417 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -58.34 -52.44 59.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.848 0.356 . . . . 0.0 110.869 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.512 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.4 mttt -66.4 -37.33 84.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.052 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.686 ' O ' HG23 ' B' ' 92' ' ' VAL . 13.8 mt-10 -63.95 -43.55 95.49 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.221 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.697 ' HD3' HG23 ' B' ' 63' ' ' ILE . 28.4 ttp180 -56.63 -49.67 74.29 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.241 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 90' ' ' ASP . . . . . 0.541 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -59.85 -43.3 94.7 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.635 -1.62 . . . . 0.0 112.225 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -43.47 74.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.675 0.216 . . . . 0.0 111.27 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.899 HG13 HD11 ' B' ' 26' ' ' LEU . 40.2 t -61.02 -42.72 94.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.668 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.3 tmmt? -59.34 -58.66 7.65 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.722 178.181 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.31 -53.91 44.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.158 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.549 ' HG ' ' CD1' ' B' ' 99' ' ' LEU . 10.7 tp -62.12 -37.13 83.95 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.182 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.456 HD12 HG12 ' B' ' 92' ' ' VAL . 26.0 mt -73.34 -41.01 63.97 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.7 -19.96 59.93 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.197 0.998 . . . . 0.0 108.971 178.259 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -93.86 -51.9 4.68 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.813 -1.54 . . . . 0.0 111.043 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.657 ' HB3' ' CE1' ' B' ' 47' ' ' TYR . 42.4 mt -75.75 -28.41 58.48 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.494 -1.685 . . . . 0.0 115.432 -176.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.619 HD22 ' HB ' ' B' ' 50' ' ' ILE . 36.4 mt -72.5 -58.18 3.08 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 18.6 Cg_endo -57.59 -19.18 35.98 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.542 2.162 . . . . 0.0 114.178 -177.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 17.9 pttm -80.5 -11.98 59.6 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.172 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.976 ' HE2' ' HA ' ' B' ' 29' ' ' GLU . 17.5 m-30 . . . . . 0 N--CA 1.466 0.357 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.772 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.879 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 57.7 tt0 . . . . . 0 CA--C 1.514 -0.421 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.607 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.2 OUTLIER -135.94 91.27 2.67 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.443 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.09 -45.22 0.47 Allowed 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -72.05 8.22 1.35 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.269 0.557 . . . . 0.0 110.774 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.994 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -52.99 120.05 5.39 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.75 179.426 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.352 -178.026 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t . . . . . 0 N--CA 1.451 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.3 mt -95.67 -31.66 13.14 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.301 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.457 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -131.37 129.3 41.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.923 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.1 mt -113.82 122.68 68.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.859 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.6 t -113.59 150.27 15.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.634 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.7 mtmp? -116.67 178.6 4.28 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.441 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 1.2 mmtm 18.45 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 O-C-N 125.2 1.562 . . . . 0.0 113.422 -178.384 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.634 HG23 ' O ' ' B' ' 13' ' ' LYS . 24.7 t -124.01 125.11 70.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.139 179.358 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.644 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.8 mpt_? -93.75 132.78 37.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.92 0.39 . . . . 0.0 110.629 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.416 ' HG3' HG13 ' B' ' 43' ' ' ILE . 5.2 tm0? -129.59 113.74 15.19 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.143 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.475 ' HD3' ' HA ' ' B' ' 18' ' ' LYS . 0.5 OUTLIER 66.4 41.03 3.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.952 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? 68.52 29.94 5.4 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.051 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.6 tp-100 -131.23 126.64 36.02 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.533 ' CG ' ' HE ' ' B' ' 16' ' ' ARG . 9.3 t0 -73.95 146.57 43.8 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.634 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -179.1 -164.69 32.18 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.656 -0.783 . . . . 0.0 113.84 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.46 136.6 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.182 0.593 . . . . 0.0 109.43 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.932 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -99.13 143.64 29.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.993 -178.452 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -137.57 115.56 11.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.82 0.343 . . . . 0.0 110.173 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.96 HD11 HG13 ' B' ' 92' ' ' VAL . 13.0 mt -94.25 128.41 40.69 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.772 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 18.8 mtt -106.44 167.98 9.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.775 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.87 65.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -176.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -121.67 4.31 10.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 30' ' ' ARG . . . . . 0.46 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.2 OUTLIER -157.84 156.59 31.71 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 119.29 -0.964 . . . . 0.0 112.68 -177.931 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.973 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -109.08 120.86 61.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 108.592 178.449 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.446 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.04 150.57 40.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.495 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.932 ' HB2' HD12 ' B' ' 24' ' ' LEU . 29.7 t90 -147.12 135.53 21.79 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.44 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -123.74 134.41 25.29 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.137 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 1.051 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -72.48 144.93 41.47 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 122.314 2.01 . . . . 0.0 111.591 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.491 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 32.2 mt-10 -64.45 129.24 39.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.157 0.503 . . . . 0.0 110.648 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.5 1.38 64.17 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.05 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 1.051 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.0 mptt -113.34 151.64 30.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.632 0.253 . . . . 0.0 110.327 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -100.15 8.09 44.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.887 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -138.97 151.67 47.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.131 0.491 . . . . 0.0 112.077 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 65.2 m-85 -86.0 121.36 28.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.585 179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -16.12 29.24 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.232 0.539 . . . . 0.0 110.529 179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.669 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 18.9 mm -113.65 118.91 59.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.752 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.3 t -148.03 101.21 3.27 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.483 ' CD2' HG23 ' B' ' 43' ' ' ILE . 54.5 m-70 -128.12 138.58 52.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.537 ' O ' HG12 ' B' ' 50' ' ' ILE . 61.6 mmm -88.33 143.64 26.89 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.2 m-85 -59.84 -21.71 61.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 110.305 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.15 -15.3 61.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.482 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.574 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.33 -10.48 18.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.29 0.567 . . . . 0.0 109.52 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.691 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.6 mm -90.31 126.29 43.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.445 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 0.1 OUTLIER -86.67 -41.0 14.56 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.286 0.565 . . . . 0.0 110.063 -179.085 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.635 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -160.71 -177.83 6.44 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.574 -179.499 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.48 140.47 26.25 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.798 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.046 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.7 mttp -105.15 156.85 17.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.293 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.743 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -132.08 126.85 57.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.414 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -90.52 118.88 69.06 Favored Pre-proline 0 C--O 1.247 0.935 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.54 172.8 11.78 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 124.67 3.58 . . . . 0.0 114.34 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -60.79 160.99 8.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.326 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.52 -29.19 7.72 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -177.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.879 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.4 mttp -89.03 146.69 24.69 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 175.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.73 -4.22 18.82 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.359 0.599 . . . . 0.0 110.392 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.706 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 16.1 pttm -139.54 125.6 19.87 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.181 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mp -78.21 137.69 21.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -136.4 163.2 31.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.578 HD13 ' HG2' ' B' ' 89' ' ' ARG . 1.1 tp -141.66 153.44 44.72 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.442 177.099 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.046 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.29 143.62 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 178.65 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.973 HD11 HD13 ' B' ' 31' ' ' ILE . 97.1 mt -97.62 106.01 18.25 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.969 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.635 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 18.5 t -90.35 111.82 23.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.483 HD22 HD13 ' B' ' 50' ' ' ILE . 6.6 mt -93.98 156.5 16.58 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.081 0.467 . . . . 0.0 112.203 -177.389 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.574 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.66 -3.45 44.11 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.247 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.26 -4.59 53.86 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.578 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.36 19.98 53.42 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -126.09 158.23 35.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.564 -0.318 . . . . 0.0 110.406 -179.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.609 HG22 ' HA ' ' B' ' 68' ' ' VAL . 16.6 p -136.0 131.53 35.13 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.564 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.6 m -107.23 108.47 19.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.188 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.607 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.8 m-20 -82.13 154.66 25.42 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.291 0.567 . . . . 0.0 112.001 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.669 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.3 m-85 -140.5 111.39 6.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.979 -1.009 . . . . 0.0 109.511 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.644 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 0.3 OUTLIER -88.56 104.84 17.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.607 -179.139 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.649 ' HZ ' HG21 ' B' ' 92' ' ' VAL . 41.6 m-85 -80.43 108.98 14.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.514 ' HB3' ' CE1' ' B' ' 78' ' ' HIS . 4.4 p -116.7 5.87 13.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -178.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.488 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -77.8 91.62 4.13 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.807 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.55 -38.64 1.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.966 0.906 . . . . 0.0 113.367 -178.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -58.26 -59.66 4.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.537 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.82 9.01 6.35 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -176.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.466 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.52 -48.3 7.38 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -177.63 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.43 -52.61 58.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.824 0.345 . . . . 0.0 110.644 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.537 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.4 mttt -67.01 -32.67 74.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.152 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.656 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.5 mt-10 -65.46 -46.12 81.07 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.299 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.633 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 4.1 tmm_? -57.94 -40.78 81.34 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 90' ' ' ASP . . . . . 0.538 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 1.6 m-20 -64.91 -47.36 78.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.016 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.35 -43.57 81.17 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.96 HG13 HD11 ' B' ' 26' ' ' LEU . 41.5 t -61.0 -41.17 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 177.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.743 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.5 tmmt? -61.32 -57.25 13.1 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.414 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -55.8 15.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.143 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.811 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.1 tp -62.04 -31.19 71.57 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.568 -178.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 23.0 mt -78.63 -43.99 24.95 Favored 'General case' 0 C--O 1.218 -0.6 0 O-C-N 122.219 -0.301 . . . . 0.0 110.749 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 97' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' B' ' 93' ' ' LYS . 21.0 mt-30 -65.56 -17.85 64.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.098 0.951 . . . . 0.0 108.87 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -87.61 -49.56 7.09 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.63 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.811 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.4 mt -81.49 -33.49 31.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 115.401 1.63 . . . . 0.0 115.401 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.718 HD23 ' HB3' ' B' ' 47' ' ' TYR . 58.8 mt -66.82 -57.27 11.95 Favored Pre-proline 0 C--N 1.317 -0.814 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.637 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 39.4 Cg_exo -58.73 -20.62 52.13 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.399 2.066 . . . . 0.0 114.211 -178.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.673 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 7.2 ptmm? -81.77 -19.72 40.7 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.537 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.445 ' HD1' ' HB2' ' B' ' 47' ' ' TYR . 24.0 m-85 . . . . . 0 C--N 1.33 -0.252 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.428 179.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.842 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.5 mt-10 . . . . . 0 CA--C 1.514 -0.414 0 CA-C-O 120.726 0.298 . . . . 0.0 111.799 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.423 ' HB3' ' OD1' ' B' ' 76' ' ' ASN . 9.6 p-10 177.86 77.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.643 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.49 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.98 -51.19 0.6 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.412 -0.805 . . . . 0.0 112.964 -178.256 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.53 9.85 0.97 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.315 0.579 . . . . 0.0 110.331 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.912 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -51.92 127.3 20.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.183 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 . . . . . 0 C--N 1.318 -0.776 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.85 -179.39 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 45.5 t . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.71 -29.56 25.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.617 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.439 HD23 ' HG ' ' B' ' 26' ' ' LEU . 7.2 tp -136.12 132.76 36.5 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 60.3 mt -117.2 120.79 66.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.803 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.9 t -112.75 148.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.406 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.593 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.47 175.95 5.26 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.285 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.566 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.17 78.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 O-C-N 125.422 1.701 . . . . 0.0 113.667 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.593 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.8 t -129.04 125.54 62.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.798 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.629 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 38.6 mtp180 -99.68 138.2 37.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.245 0.545 . . . . 0.0 111.502 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.416 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -124.92 114.27 18.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 176.714 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 0.0 OUTLIER 68.64 31.34 4.68 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.79 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 76.24 13.06 2.63 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 114.343 -1.298 . . . . 0.0 112.148 -179.763 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.629 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 5.7 tp-100 -105.85 118.9 37.79 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -77.27 149.98 35.36 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 -177.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.731 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -178.39 -155.39 14.3 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.817 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.85 137.6 51.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.139 0.495 . . . . 0.0 110.156 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 1.0 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.47 138.97 34.09 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.006 -178.383 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -134.06 110.14 9.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.68 0.276 . . . . 0.0 110.338 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.92 HD11 HG13 ' B' ' 92' ' ' VAL . 10.8 mt -87.71 129.0 35.3 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.069 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 21.7 mtt -109.27 169.1 8.91 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.968 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.88 -50.61 14.22 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -115.29 6.53 14.96 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -158.42 157.6 32.58 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 119.532 -0.867 . . . . 0.0 112.86 -178.083 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.87 HD13 HD11 ' B' ' 67' ' ' LEU . 1.3 tt -106.77 116.47 50.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 178.049 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -117.97 151.75 36.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.988 0.423 . . . . 0.0 111.044 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 1.0 ' HB2' HD12 ' B' ' 24' ' ' LEU . 47.4 t90 -147.14 136.41 22.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.873 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.47 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -125.73 133.22 24.69 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.382 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 1.001 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 5.6 Cg_exo -74.81 148.68 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.596 2.197 . . . . 0.0 111.62 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.572 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 73.5 mt-10 -65.54 130.86 44.8 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.102 0.477 . . . . 0.0 110.829 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.03 2.19 62.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.129 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 1.001 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 4.3 mptt -113.28 148.89 34.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.691 0.281 . . . . 0.0 110.337 179.692 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -98.06 5.86 48.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.603 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -141.34 152.83 44.74 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.158 0.504 . . . . 0.0 111.844 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -82.98 122.87 28.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.902 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -90.87 -18.61 24.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.31 0.576 . . . . 0.0 110.532 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.626 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 18.1 mm -112.49 117.84 56.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.392 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 25.9 t -148.06 101.46 3.29 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.464 ' CD2' HG23 ' B' ' 43' ' ' ILE . 48.8 m-70 -125.11 138.04 54.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.986 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.504 ' O ' HG12 ' B' ' 50' ' ' ILE . 67.5 mmm -87.94 143.54 27.05 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.5 m-85 -58.73 -21.86 56.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.907 0.384 . . . . 0.0 110.516 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.91 -13.1 60.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.679 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.599 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.4 -10.67 16.83 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.321 0.582 . . . . 0.0 109.586 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.618 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.6 mm -89.37 127.21 42.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.592 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.445 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 21.9 tttp -84.8 -44.53 13.19 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.459 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -161.29 -178.03 6.42 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.052 -0.976 . . . . 0.0 108.731 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -144.49 142.15 30.06 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.259 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.133 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 28.6 mttp -108.61 155.26 20.88 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.704 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.51 127.65 62.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 176.447 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.432 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -90.64 116.91 67.46 Favored Pre-proline 0 C--O 1.249 1.029 0 C-N-CA 120.016 -0.674 . . . . 0.0 109.432 -179.041 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 57' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 73.6 Cg_endo -69.36 173.37 10.72 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 125.24 3.96 . . . . 0.0 113.767 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -58.38 160.33 5.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.647 -1.16 . . . . 0.0 110.092 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.2 7.87 Favored Glycine 0 C--N 1.315 -0.605 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.776 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 6.7 mttm -88.66 152.92 21.51 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.4 -9.11 55.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.335 0.588 . . . . 0.0 110.456 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.842 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.65 141.98 37.02 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.689 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.693 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -83.85 130.19 36.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.478 HE21 ' HB2' ' B' ' 64' ' ' GLN . 3.6 mt-30 -132.05 162.78 29.94 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 118.805 -1.158 . . . . 0.0 113.851 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.432 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 2.0 tp -139.91 153.56 47.0 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.851 -1.522 . . . . 0.0 107.272 177.06 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.133 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.97 138.21 25.35 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.311 178.869 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.87 HD11 HD13 ' B' ' 31' ' ' ILE . 71.8 mt -94.17 104.94 16.94 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.501 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.736 ' HA ' HG22 ' B' ' 74' ' ' THR . 10.7 t -89.09 109.07 19.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.532 HD22 HD13 ' B' ' 50' ' ' ILE . 2.3 mt -93.82 157.26 16.22 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.985 -177.015 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -81.31 1.04 34.39 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.232 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -16.17 59.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.548 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 104.25 7.59 40.15 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.939 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 73' ' ' ASP . . . . . 0.498 ' OD1' HD12 ' B' ' 69' ' ' LEU . 8.7 p-10 -126.37 170.42 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.206 0.527 . . . . 0.0 111.859 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.736 HG22 ' HA ' ' B' ' 68' ' ' VAL . 8.8 p -137.57 131.93 32.39 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.763 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 9.6 m -103.98 112.56 25.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.73 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.456 ' ND2' ' HB2' ' B' ' 66' ' ' GLN . 0.7 OUTLIER -84.51 153.87 23.04 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.628 0.728 . . . . 0.0 112.164 -179.007 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.572 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 36.7 m-85 -133.62 111.86 10.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.573 178.043 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.556 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t60 -86.59 98.97 11.38 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.701 -177.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.805 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 41.8 m-85 -77.06 95.57 4.23 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.42 4.97 44.2 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.566 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -80.3 91.35 5.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.125 0.488 . . . . 0.0 110.297 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.18 -42.1 4.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.325 -0.852 . . . . 0.0 113.173 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -59.75 4.72 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.267 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 18.1 p -127.62 8.75 6.43 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.805 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.75 -47.93 7.99 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -178.356 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.436 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.11 -52.03 65.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.845 0.355 . . . . 0.0 111.016 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.575 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 6.4 mptt -67.67 -35.09 78.21 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.036 0.446 . . . . 0.0 109.817 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.672 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -64.75 -44.79 88.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.426 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.693 ' HD3' HG23 ' B' ' 63' ' ' ILE . 28.3 ttp180 -54.55 -47.64 72.97 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.379 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 90' ' ' ASP . . . . . 0.673 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -61.94 -44.86 95.9 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.293 179.687 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.39 -41.43 80.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 117.79 0.268 . . . . 0.0 111.406 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.92 HG13 HD11 ' B' ' 26' ' ' LEU . 41.1 t -62.42 -42.23 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 177.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.704 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.1 tmmt? -59.43 -56.97 15.26 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.436 177.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.92 -52.99 58.83 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.148 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.777 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.9 tp -61.19 -42.77 99.17 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.038 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.418 HD12 HG12 ' B' ' 92' ' ' VAL . 21.2 mt -68.01 -43.89 77.8 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.18 -24.1 66.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.066 0.936 . . . . 0.0 109.381 178.662 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -84.9 -49.98 7.91 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.326 -1.306 . . . . 0.0 110.74 178.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.777 HD12 ' HG ' ' B' ' 95' ' ' LEU . 11.9 mt -77.09 -47.28 20.92 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 113.574 -1.648 . . . . 0.0 115.257 -176.469 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.718 HD23 ' HB3' ' B' ' 47' ' ' TYR . 33.0 mt -50.19 -54.8 30.04 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -176.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 25.9 Cg_endo -60.64 -16.49 43.44 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.091 1.861 . . . . 0.0 113.337 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -87.77 -8.73 55.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.269 179.942 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.975 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.3 tt0 . . . . . 0 CA--C 1.514 -0.41 0 CA-C-O 120.858 0.361 . . . . 0.0 111.304 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.646 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 13.1 p-10 -136.59 93.21 2.84 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.753 0.787 . . . . 0.0 111.803 -178.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.521 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.2 p-10 -139.29 -44.72 0.46 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 16.2 p30 -74.41 12.8 0.69 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.718 0.77 . . . . 0.0 110.103 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.756 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -55.29 121.54 9.13 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.673 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 C--N 1.314 -0.94 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.426 -178.344 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 120.826 0.346 . . . . 0.0 110.289 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 82.4 mt -87.16 -31.93 20.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.711 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.422 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -138.53 134.5 33.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.402 HG23 ' CE1' ' B' ' 25' ' ' TYR . 68.3 mt -117.61 124.18 72.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.753 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.2 t -115.65 149.96 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.652 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.643 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -111.17 179.3 4.08 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.43 -178.943 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.542 ' H ' ' HD2' ' B' ' 14' ' ' LYS . 1.3 mptp? 18.55 70.63 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 O-C-N 124.978 1.424 . . . . 0.0 113.939 -179.049 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.668 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.0 t -123.39 120.35 59.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.151 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.541 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 3.2 mtm180 -92.38 142.39 27.49 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.198 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.58 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.33 105.38 5.21 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.17 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 mptt 71.91 49.24 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.887 0.742 . . . . 0.0 110.818 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 7.9 mptt 70.6 27.66 3.72 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.658 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.8 pt20 -145.98 132.46 19.73 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.911 -0.493 . . . . 0.0 110.649 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -80.06 153.17 28.95 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.967 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.525 ' HA2' ' H ' ' B' ' 36' ' ' GLU . . . -178.09 -162.67 28.35 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.239 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.99 137.44 54.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.062 0.458 . . . . 0.0 109.863 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.917 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.3 tp -98.01 141.51 30.88 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.24 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 25' ' ' TYR . . . . . 0.402 ' CE1' HG23 ' B' ' 11' ' ' ILE . 34.5 m-85 -136.57 113.7 10.61 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.796 HD11 HG13 ' B' ' 92' ' ' VAL . 14.7 mt -90.53 130.99 36.52 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.34 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 15.0 mtt -112.13 159.89 18.09 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.03 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.3 -40.31 5.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -119.53 -4.44 10.34 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 27.2 ptt180 -151.72 158.63 43.64 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.534 -177.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 1.016 HD13 HD11 ' B' ' 67' ' ' LEU . 1.7 tt -107.83 120.49 59.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -120.26 146.85 45.67 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.001 0.429 . . . . 0.0 110.694 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.917 ' HB2' HD12 ' B' ' 24' ' ' LEU . 24.1 t90 -146.83 140.07 25.48 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.574 ' HB2' ' HA ' ' B' ' 41' ' ' PHE . . . -133.93 141.05 38.3 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.798 -179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.507 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 14.3 Cg_exo -65.94 141.51 64.96 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.383 2.055 . . . . 0.0 110.522 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.525 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 4.4 mt-10 -64.57 116.0 5.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.318 0.58 . . . . 0.0 109.589 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 109.61 3.29 30.62 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.569 ' HA ' ' NZ ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -107.14 148.5 28.75 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.403 0.62 . . . . 0.0 111.306 179.467 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -93.32 -22.35 19.02 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.473 -1.24 . . . . 0.0 111.828 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.1 133.77 55.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.73 0.3 . . . . 0.0 111.174 -178.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.574 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 75.2 m-85 -68.66 120.98 15.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 42' ' ' THR . . . . . 0.437 ' OG1' ' HD3' ' B' ' 35' ' ' PRO . 0.8 OUTLIER -79.91 -39.33 30.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.023 0.44 . . . . 0.0 110.638 -179.799 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.65 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 17.6 mm -93.08 119.12 40.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.954 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -147.95 101.22 3.28 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.472 ' CD2' HG23 ' B' ' 43' ' ' ILE . 52.3 m-70 -132.05 143.32 49.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.935 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.4 ' O ' HG12 ' B' ' 50' ' ' ILE . 5.9 mtp -91.36 145.16 24.87 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.002 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.742 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.51 -21.69 39.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.045 0.45 . . . . 0.0 110.413 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.65 -10.7 59.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.992 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.593 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.01 -4.59 17.69 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.315 0.578 . . . . 0.0 109.831 179.624 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.702 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.7 mm -90.3 132.84 33.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.541 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 17.7 ttpt -88.86 -41.84 12.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.274 0.559 . . . . 0.0 109.713 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.734 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 24.3 p -162.35 -178.0 6.03 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.403 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -146.73 139.24 25.01 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.741 0.305 . . . . 0.0 110.853 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.049 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 19.0 mttp -109.58 156.5 20.1 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.545 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.37 128.09 63.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 176.048 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -89.03 118.92 69.68 Favored Pre-proline 0 C--O 1.249 1.036 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.243 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.32 173.18 13.49 Favored 'Trans proline' 0 C--O 1.234 0.316 1 C-N-CA 125.311 4.008 . . . . 0.0 114.559 -177.322 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -60.21 160.98 7.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.201 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.31 -29.14 7.82 Favored Glycine 0 C--N 1.316 -0.53 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.975 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 10.0 mttp -90.7 154.0 19.87 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 2.76 8.49 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.236 0.541 . . . . 0.0 110.502 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.23 148.04 32.08 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.526 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.636 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -96.86 136.54 27.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.405 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 10.5 mt-30 -138.7 163.24 32.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.421 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.585 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.6 153.59 47.4 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 113.812 -1.54 . . . . 0.0 106.862 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.049 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -145.99 134.49 22.03 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 119.302 0.955 . . . . 0.0 111.266 178.845 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 1.016 HD11 HD13 ' B' ' 31' ' ' ILE . 26.0 mt -94.15 104.15 16.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.768 178.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.734 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -88.62 103.73 14.1 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.592 HD22 HD13 ' B' ' 50' ' ' ILE . 2.4 mt -89.25 157.86 18.07 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.05 -177.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.593 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.3 0.27 37.77 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.018 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.79 -10.16 59.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.15 11.57 54.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.002 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -126.41 154.72 43.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.563 HG22 ' HA ' ' B' ' 68' ' ' VAL . 13.7 p -124.11 131.01 53.5 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.584 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 1.4 m -103.64 98.63 8.48 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.535 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 4.8 m-20 -85.74 122.36 29.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.404 0.621 . . . . 0.0 111.885 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.632 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 63.0 m-85 -103.81 113.37 26.85 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.008 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.668 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.9 t60 -86.59 100.0 12.11 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.041 -178.25 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.684 ' CE1' HG11 ' B' ' 12' ' ' VAL . 54.8 m-85 -76.84 88.18 3.44 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.09 13.09 35.69 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.536 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.8 t-20 -83.22 92.94 7.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.318 0.58 . . . . 0.0 109.933 179.348 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.06 -34.9 0.79 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.84 -59.57 3.42 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -178.363 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.514 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -127.36 11.6 6.92 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -176.151 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.9 -47.87 11.24 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.043 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.96 -52.1 65.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.887 0.375 . . . . 0.0 110.817 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.514 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.8 mttt -66.6 -34.11 77.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.922 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.63 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.1 mt-10 -65.71 -44.44 86.08 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.636 ' HD3' HG23 ' B' ' 63' ' ' ILE . 26.2 ttp180 -56.29 -47.86 77.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.451 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 90' ' ' ASP . . . . . 0.545 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.43 -44.38 96.55 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 113.865 -1.516 . . . . 0.0 112.381 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.14 -44.46 79.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.767 0.258 . . . . 0.0 111.312 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.796 HG13 HD11 ' B' ' 26' ' ' LEU . 48.9 t -60.33 -44.09 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.545 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.1 tmmt? -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.724 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -55.53 25.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.895 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.683 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.4 tp -63.26 -32.56 74.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.139 -179.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.515 HD12 HG12 ' B' ' 92' ' ' VAL . 20.9 mt -76.36 -39.26 54.32 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -66.08 -18.58 65.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.289 1.042 . . . . 0.0 108.621 178.393 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -87.88 -48.4 7.84 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.521 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.683 HD12 ' HG ' ' B' ' 95' ' ' LEU . 16.3 mt -82.8 -37.32 24.68 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 -176.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.742 HD23 ' HB3' ' B' ' 47' ' ' TYR . 66.4 mt -63.48 -58.44 15.48 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.689 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 37.7 Cg_exo -58.57 -23.49 65.23 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.245 1.964 . . . . 0.0 113.499 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.526 ' HG2' ' HA ' ' B' ' 99' ' ' LEU . 2.3 ptmm? -88.15 1.37 54.52 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.467 ' HD1' ' O ' ' B' ' 99' ' ' LEU . 21.6 m-85 . . . . . 0 C--N 1.33 -0.262 0 CA-C-O 120.705 0.288 . . . . 0.0 111.132 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.945 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.7 tt0 . . . . . 0 CA--C 1.513 -0.466 0 CA-C-O 120.92 0.39 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.611 ' HB2' ' CE2' ' A' ' 403' ' ' PHE . 11.8 p-10 -134.0 94.46 3.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.76 0.79 . . . . 0.0 111.857 -178.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.496 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.42 -46.98 0.46 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -73.31 12.09 0.64 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.377 0.608 . . . . 0.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 0.674 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -53.29 115.96 2.17 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.596 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 C--N 1.321 -0.66 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.577 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 90.9 t . . . . . 0 CA--C 1.516 -0.342 0 CA-C-O 121.371 0.605 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.508 ' HB2' HD21 ' B' ' 95' ' ' LEU . 23.4 mt -97.79 -31.61 12.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.34 179.138 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.3 tp -132.97 137.8 46.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.8 mt -122.34 121.59 64.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.737 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.5 t -110.6 148.67 13.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.136 -179.373 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.559 ' HD3' ' N ' ' B' ' 13' ' ' LYS . 0.1 OUTLIER -108.3 174.09 6.03 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.673 -178.78 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 18.0 70.05 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 O-C-N 125.084 1.49 . . . . 0.0 114.27 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.558 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.1 t -116.21 120.98 66.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.612 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 31.9 mtp180 -96.7 119.85 35.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.154 0.502 . . . . 0.0 110.953 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' B' ' 76' ' ' ASN . 10.7 tm0? -109.98 119.84 40.58 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.601 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 65.56 33.52 8.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -178.262 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.35 18.65 7.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.332 -1.304 . . . . 0.0 111.552 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tp-100 -110.12 119.1 38.21 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.33 144.4 56.59 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.741 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . -178.92 -165.94 34.12 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.409 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.59 136.81 53.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.071 0.462 . . . . 0.0 109.897 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.948 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.81 142.22 29.84 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.4 -177.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -135.03 124.16 24.38 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.845 HD11 HG13 ' B' ' 92' ' ' VAL . 19.3 mt -105.3 121.11 43.19 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.643 -178.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -97.88 159.13 15.13 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.79 -21.54 56.27 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -116.87 -16.85 10.55 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -154.84 164.73 38.4 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.374 -176.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 1.005 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -114.32 122.55 68.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.233 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -125.45 152.55 44.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.033 0.444 . . . . 0.0 110.512 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.948 ' HB2' HD12 ' B' ' 24' ' ' LEU . 21.9 t90 -146.87 136.81 23.3 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.453 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -122.38 135.35 25.46 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.185 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 1.081 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 4.8 Cg_exo -72.08 150.09 53.57 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.54 2.16 . . . . 0.0 111.803 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.741 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.1 mt-10 -63.66 124.41 21.36 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.928 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.59 6.47 62.43 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 1.081 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 10.0 mptt -113.32 149.71 33.57 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -97.06 -1.39 45.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.888 -178.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -132.63 151.07 52.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.169 0.509 . . . . 0.0 112.055 -178.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.422 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 44.1 m-85 -83.88 121.26 27.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.678 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.1 p -87.53 -21.85 25.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.208 0.528 . . . . 0.0 110.487 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.608 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 11.5 mm -102.39 122.98 55.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.23 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.3 t -147.68 101.56 3.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.183 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.503 ' CD2' HG23 ' B' ' 43' ' ' ILE . 51.0 m-70 -133.99 139.44 46.06 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.473 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.4 mtp -96.94 148.68 22.71 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.659 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.4 m-85 -58.18 -23.2 54.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.853 0.359 . . . . 0.0 111.287 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.99 -25.28 62.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.053 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.599 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -97.15 -4.76 38.66 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.823 0.344 . . . . 0.0 110.833 -179.614 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.564 HD13 HD22 ' B' ' 69' ' ' LEU . 4.1 mm -83.45 131.48 33.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.458 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 13.7 tttm -91.94 -37.19 13.01 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.73 0.3 . . . . 0.0 110.352 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.588 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.6 p -169.39 179.97 3.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -139.83 143.83 37.0 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.271 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.125 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 16.9 mttm -115.3 150.1 36.78 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.507 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.526 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -130.57 129.25 64.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.653 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.471 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -91.34 121.15 67.99 Favored Pre-proline 0 C--O 1.249 1.028 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.283 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -72.56 173.44 13.27 Favored 'Trans proline' 0 C--O 1.234 0.318 1 C-N-CA 125.586 4.191 . . . . 0.0 114.733 -177.539 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -58.67 160.64 5.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.407 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.92 -29.01 8.03 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 -178.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.945 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.9 mttp -89.81 154.62 19.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.404 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.3 -11.85 61.18 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.216 0.532 . . . . 0.0 110.299 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.659 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.15 140.84 40.04 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.769 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.57 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.3 mp -85.21 140.3 16.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 64' ' ' GLN . . . . . 0.471 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 91.7 mt-30 -139.94 163.18 33.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.284 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.473 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.3 tp -142.54 153.54 43.67 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.339 176.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.125 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 137.22 23.73 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 119.241 0.928 . . . . 0.0 110.939 178.281 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 1.005 HD11 HD13 ' B' ' 31' ' ' ILE . 96.4 mt -94.14 104.09 16.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.869 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.588 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 5.7 t -88.59 110.78 21.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.564 HD22 HD13 ' B' ' 50' ' ' ILE . 4.4 mt -97.57 155.9 16.76 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.075 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.6 OUTLIER -81.67 2.95 27.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.013 178.218 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.85 -5.83 59.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.157 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.31 16.14 53.94 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.547 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -126.12 154.3 43.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.759 0.314 . . . . 0.0 110.775 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.549 HG22 ' HA ' ' B' ' 68' ' ' VAL . 17.0 p -130.23 130.71 44.95 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.59 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.2 m -106.56 98.98 8.58 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.62 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.494 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 5.3 m-20 -82.41 147.09 28.97 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.848 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.51 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 59.2 m-85 -131.24 112.71 13.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.834 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.612 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.5 t-80 -87.03 99.91 12.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.285 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.692 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 43.1 m-85 -75.07 100.02 4.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.53 11.4 28.76 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -85.66 91.66 8.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.243 0.544 . . . . 0.0 109.733 179.119 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.58 -34.23 2.07 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.705 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.23 -57.66 7.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.511 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.48 8.72 6.5 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -176.322 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.692 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.93 -47.27 8.43 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -178.208 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 t -59.84 -54.18 38.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.915 0.388 . . . . 0.0 110.747 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -65.55 -33.36 75.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.959 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.674 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.7 mt-10 -66.09 -45.39 81.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.57 ' HD3' HG23 ' B' ' 63' ' ' ILE . 17.6 ttp180 -56.06 -47.91 77.04 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 90' ' ' ASP . . . . . 0.725 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -61.22 -44.19 97.67 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 113.619 -1.628 . . . . 0.0 111.96 179.797 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.61 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.704 0.229 . . . . 0.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.845 HG13 HD11 ' B' ' 26' ' ' LEU . 45.4 t -62.81 -44.69 99.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.725 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.8 OUTLIER -58.82 -52.68 64.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.793 178.254 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 94' ' ' ASP . . . . . 0.457 ' HA ' ' HG2' ' B' ' 97' ' ' GLN . 1.2 m-20 -58.67 -53.29 59.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.81 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.718 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.2 tp -60.64 -38.58 85.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.401 HD12 HG12 ' B' ' 92' ' ' VAL . 25.8 mt -70.15 -45.44 66.76 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 178.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 97' ' ' GLN . . . . . 0.457 ' HG2' ' HA ' ' B' ' 94' ' ' ASP . 19.7 pt20 -64.85 -18.07 64.83 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.218 1.009 . . . . 0.0 109.195 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -85.91 -49.78 7.61 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.928 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.718 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -78.96 -47.25 16.68 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.473 -1.694 . . . . 0.0 115.146 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.659 HD23 ' HB3' ' B' ' 47' ' ' TYR . 34.9 mt -52.23 -56.3 23.43 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.295 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 32.2 Cg_exo -61.59 -13.43 29.72 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.398 2.065 . . . . 0.0 113.417 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 7.9 mtmm -85.48 -23.17 27.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.982 0.42 . . . . 0.0 110.285 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 . . . . . 0 C--N 1.325 -0.495 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.944 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 399' ' ' GLU . . . . . 0.869 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 63.0 tt0 . . . . . 0 CA--C 1.509 -0.624 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 400' ' ' ASP . . . . . 0.631 ' HB3' ' CD1' ' A' ' 403' ' ' PHE . 0.8 OUTLIER -133.67 90.74 2.75 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -175.513 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 401' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -138.99 -48.41 0.5 Allowed 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -72.06 13.59 0.29 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.929 0.871 . . . . 0.0 110.538 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 403' ' ' PHE . . . . . 1.004 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -61.68 119.39 8.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.192 -1.367 . . . . 0.0 111.025 179.553 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.775 -179.082 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.42 HG11 HG12 ' B' ' 11' ' ' ILE . 63.9 t . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.7 mt -82.78 -31.11 28.42 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.515 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.6 tp -132.53 123.03 25.74 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.42 HG12 HG11 ' B' ' 8' ' ' VAL . 73.1 mt -109.6 120.64 61.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 177.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 12' ' ' VAL . . . . . 0.758 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.0 t -112.91 149.62 15.32 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 13' ' ' LYS . . . . . 0.61 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -109.48 -179.94 3.97 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.984 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 14' ' ' LYS . . . . . 0.429 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.8 mttp 17.95 76.31 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 125.393 1.683 . . . . 0.0 113.533 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.61 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.6 t -127.9 125.0 64.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.596 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 1.4 mtt-85 -99.04 146.11 26.39 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.388 0.614 . . . . 0.0 112.201 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 17' ' ' GLN . . . . . 0.536 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 53.1 tp60 -119.75 102.71 8.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 18' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 1.1 mptp? 55.61 56.73 5.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.104 -178.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 3.2 mptm? 76.33 9.75 3.1 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 178.056 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 20' ' ' GLN . . . . . 0.691 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 5.9 pt20 -119.56 119.65 34.41 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.173 0.897 . . . . 0.0 110.755 178.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.538 ' OD2' ' HD3' ' B' ' 16' ' ' ARG . 2.1 m-20 -72.42 149.68 44.04 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.639 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -175.98 -161.31 24.97 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.744 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.36 139.45 53.66 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.884 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.75 137.28 39.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.743 -178.547 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -133.46 108.72 8.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.826 0.346 . . . . 0.0 110.412 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.954 HD11 HG13 ' B' ' 92' ' ' VAL . 10.7 mt -84.59 121.42 27.6 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.905 0.383 . . . . 0.0 110.332 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 27' ' ' MET . . . . . 0.451 ' HB2' ' HG2' ' B' ' 30' ' ' ARG . 0.5 OUTLIER -99.38 166.32 11.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.486 -178.802 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.2 -52.99 8.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 29' ' ' GLU . . . . . 0.454 ' CD ' HH21 ' B' ' 30' ' ' ARG . 1.5 mp0 -114.2 7.03 16.46 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.016 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 30' ' ' ARG . . . . . 0.454 HH21 ' CD ' ' B' ' 29' ' ' GLU . 10.1 ptp180 -158.94 157.86 32.2 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.513 -0.875 . . . . 0.0 112.682 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 31' ' ' ILE . . . . . 0.966 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -103.68 119.03 51.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.345 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.529 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -115.31 147.07 40.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.911 0.386 . . . . 0.0 110.801 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 33' ' ' TRP . . . . . 0.884 ' HB2' HD12 ' B' ' 24' ' ' LEU . 35.9 t90 -147.18 145.46 29.51 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.269 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 1.064 ' HB1' ' HG3' ' B' ' 38' ' ' LYS . . . -145.44 133.23 10.45 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.746 -0.206 . . . . 0.0 111.183 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 35' ' ' PRO . . . . . 0.639 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 69.7 Cg_endo -70.68 132.77 22.48 Favored 'Trans proline' 0 N--CA 1.476 0.474 0 C-N-CA 123.457 2.771 . . . . 0.0 111.79 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.546 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 0.0 OUTLIER -50.3 132.17 24.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.194 -178.453 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.73 11.03 39.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -177.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 1.064 ' HG3' ' HB1' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -99.62 166.7 11.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.585 -0.807 . . . . 0.0 111.953 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -124.22 -4.98 7.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.444 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -146.2 164.09 33.35 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.259 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.66 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 36.2 m-85 -88.22 130.86 34.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.229 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.3 p -94.33 -25.92 16.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.56 . . . . 0.0 110.32 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.768 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -106.04 120.68 57.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.302 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 45.8 t -147.91 101.43 3.3 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 45' ' ' HIS . . . . . 0.422 ' CD2' HG23 ' B' ' 43' ' ' ILE . 79.9 m-70 -123.33 137.96 54.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 46' ' ' MET . . . . . 0.472 ' O ' HG12 ' B' ' 50' ' ' ILE . 70.9 mmm -85.9 140.91 29.96 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.709 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.9 m-85 -57.66 -22.85 48.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.969 0.414 . . . . 0.0 110.501 179.3 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.77 -22.31 60.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.807 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.617 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -96.32 -6.82 36.87 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.11 0.481 . . . . 0.0 110.067 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.64 ' HB ' HD22 ' B' ' 100' ' ' LEU . 4.4 mm -87.28 118.22 32.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.618 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 0.6 OUTLIER -79.39 -30.88 42.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.226 0.536 . . . . 0.0 109.615 -178.655 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.618 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 9.4 p -176.1 173.69 2.17 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.751 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 18.8 pm0 -132.42 137.91 47.46 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.199 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 1.137 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -104.75 148.97 26.02 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.517 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.8 OUTLIER -127.25 127.04 68.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 175.998 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -88.3 116.66 66.88 Favored Pre-proline 0 C--O 1.252 1.188 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.83 173.3 11.23 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 125.211 3.941 . . . . 0.0 114.484 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -60.73 160.33 9.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.47 -29.06 8.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.331 -1.507 . . . . 0.0 109.331 -177.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.869 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.5 mttp -88.45 152.26 22.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 176.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.4 -8.98 51.42 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 121.127 0.489 . . . . 0.0 110.942 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 62' ' ' LYS . . . . . 0.508 ' CE ' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -141.74 140.8 33.2 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.597 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 63' ' ' ILE . . . . . 0.594 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.4 mp -86.31 135.49 24.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 178.347 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -139.5 163.31 32.88 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 118.897 -1.121 . . . . 0.0 113.992 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 1.7 tp -138.88 153.07 48.26 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.054 -1.43 . . . . 0.0 107.522 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 1.137 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 142.96 28.3 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 119.25 0.932 . . . . 0.0 111.183 178.201 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.966 HD11 HD13 ' B' ' 31' ' ' ILE . 95.7 mt -95.29 103.13 14.98 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.925 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.743 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.3 t -87.12 115.94 28.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.534 HD22 HD13 ' B' ' 50' ' ' ILE . 4.1 mt -101.13 154.87 18.36 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.11 0.481 . . . . 0.0 111.952 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.617 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.43 -1.95 36.05 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.384 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.99 -15.3 61.1 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.63 178.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 102.8 7.45 44.61 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.929 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 73' ' ' ASP . . . . . 0.488 ' OD2' HD12 ' B' ' 69' ' ' LEU . 4.8 p-10 -126.44 167.71 15.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.117 0.484 . . . . 0.0 111.572 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 74' ' ' THR . . . . . 0.743 HG22 ' HA ' ' B' ' 68' ' ' VAL . 33.2 p -136.63 131.45 33.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.752 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 75' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.2 m -100.57 99.33 9.89 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 178.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 76' ' ' ASN . . . . . 0.44 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.5 m-20 -82.46 148.17 28.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.238 0.542 . . . . 0.0 111.485 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 77' ' ' PHE . . . . . 0.768 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 54.0 m-85 -131.59 113.99 14.3 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.767 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 78' ' ' HIS . . . . . 0.563 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.8 t-160 -87.05 105.3 17.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.447 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.751 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 29.0 m-85 -76.41 97.48 4.29 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.401 ' HB3' ' CZ ' ' B' ' 16' ' ' ARG . 0.6 OUTLIER -95.18 7.27 46.67 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.922 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 81' ' ' ASN . . . . . 0.429 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 54.7 t30 -81.35 91.19 6.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.128 0.49 . . . . 0.0 110.451 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.66 -24.97 9.52 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.209 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -59.98 2.46 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 84' ' ' THR . . . . . 0.525 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.7 p -127.82 13.46 6.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -176.742 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 85' ' ' ALA . . . . . 0.751 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -46.15 -44.36 15.79 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.447 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.6 -53.52 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.027 0.442 . . . . 0.0 110.488 179.541 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.525 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.48 -34.91 78.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.264 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 88' ' ' GLU . . . . . 0.672 ' O ' HG23 ' B' ' 92' ' ' VAL . 13.5 mt-10 -67.5 -44.22 78.99 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 89' ' ' ARG . . . . . 0.594 ' HD3' HG23 ' B' ' 63' ' ' ILE . 22.5 ttp180 -55.42 -47.08 76.52 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.133 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -42.28 99.27 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.57 -1.65 . . . . 0.0 112.466 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.47 -43.65 76.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.72 0.236 . . . . 0.0 111.078 179.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.954 HG13 HD11 ' B' ' 26' ' ' LEU . 35.2 t -60.28 -44.45 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 177.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' B' ' 97' ' ' GLN . 0.5 OUTLIER -58.18 -54.87 42.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.089 178.337 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 94' ' ' ASP . . . . . 0.452 ' HA ' ' OE1' ' B' ' 97' ' ' GLN . 4.2 m-20 -56.73 -53.95 51.88 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.195 -179.069 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.646 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.5 tp -61.56 -32.67 72.76 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.472 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.63 -41.12 65.86 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 97' ' ' GLN . . . . . 0.452 ' OE1' ' HA ' ' B' ' 94' ' ' ASP . 58.2 mt-30 -63.08 -22.67 67.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.149 0.976 . . . . 0.0 108.684 178.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.63 -47.42 9.2 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.793 -1.549 . . . . 0.0 111.439 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 99' ' ' LEU . . . . . 0.646 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.7 mt -80.05 -47.76 14.35 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.124 -1.398 . . . . 0.0 114.757 -176.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.709 HD23 ' HB3' ' B' ' 47' ' ' TYR . 59.2 mt -52.55 -56.97 17.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -176.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 101' ' ' PRO . . . . . 0.652 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.1 Cg_exo -56.83 -13.19 10.74 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.711 2.274 . . . . 0.0 113.875 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -87.15 -9.5 55.09 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.368 -0.208 . . . . 0.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.496 -179.774 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 30.2 p90 . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 23.1 t -61.48 119.83 6.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.758 0.313 . . . . 0.0 110.545 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 87.83 -78.02 1.84 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.77 -0.728 . . . . 0.0 111.331 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -91.45 119.96 31.88 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -133.81 29.24 3.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.798 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.516 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -60.31 -35.57 75.91 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.342 179.033 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 4.1 tt0 169.21 -79.25 0.0 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.693 177.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.984 ' HG3' ' HE2' ' B' ' 62' ' ' LYS . 0.5 OUTLIER -139.78 113.12 8.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.255 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 400' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -138.44 84.46 2.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.203 -178.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.544 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -139.09 -49.49 0.51 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.234 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -71.29 11.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.602 0.715 . . . . 0.0 110.177 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.728 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -54.76 114.12 1.59 Allowed 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.186 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -94.36 133.1 38.28 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.268 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.43 ' HG2' ' HG2' ' B' ' 54' ' ' LYS . 23.2 mm-40 -81.14 175.09 10.94 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.952 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -164.28 -22.22 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.104 -0.638 . . . . 0.0 111.738 178.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.78 -19.75 37.18 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.157 179.283 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 75.82 -174.4 0.11 Allowed 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.598 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.27 86.23 3.7 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 121.568 0.699 . . . . 0.0 111.232 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.64 ' HB3' ' HG2' ' B' ' 51' ' ' LYS . 16.1 t70 . . . . . 0 C--O 1.245 0.865 0 CA-C-N 115.142 -0.936 . . . . 0.0 109.43 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.63 61.86 0.31 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 109.945 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 12.7 m -156.64 -68.07 0.11 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.674 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.52 -18.7 14.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.949 0.404 . . . . 0.0 111.051 -179.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' SER . . . . . 0.505 ' HB3' ' HB2' ' B' ' 29' ' ' GLU . 4.6 p -76.79 19.73 0.27 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.85 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -105.77 2.08 27.57 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.852 0.834 . . . . 0.0 109.039 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -112.76 135.92 52.96 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.938 -1.483 . . . . 0.0 108.891 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 99.0 t -93.34 122.52 44.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.19 0.519 . . . . 0.0 111.471 -178.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.5 mt -95.57 -29.51 14.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.498 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.605 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.07 123.91 26.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.749 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.442 HG23 ' CE1' ' B' ' 25' ' ' TYR . 55.5 mt -108.95 122.65 63.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.839 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.9 t -115.07 150.05 17.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.611 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.66 177.25 4.74 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.064 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.579 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.15 75.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 125.555 1.784 . . . . 0.0 112.971 -178.654 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.611 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.1 t -123.82 119.7 57.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.1 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.593 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 30.8 mtp180 -89.42 128.42 35.94 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.858 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.41 ' NE2' ' HD2' ' B' ' 18' ' ' LYS . 14.7 tm0? -126.9 104.33 7.97 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.68 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.22 50.88 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.771 179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.516 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 0.3 OUTLIER 66.26 26.13 10.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.752 178.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.523 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.1 tt0 -138.31 121.59 17.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.776 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.436 ' HA ' ' HA ' ' B' ' 16' ' ' ARG . 2.1 t70 -76.94 154.0 34.06 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.894 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -178.27 -156.12 15.97 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.218 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 133.57 48.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.955 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.47 142.19 29.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.516 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' TYR . . . . . 0.442 ' CE1' HG23 ' B' ' 11' ' ' ILE . 50.3 m-85 -137.72 110.59 7.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.97 HD11 HG13 ' B' ' 92' ' ' VAL . 9.3 mt -87.97 128.45 35.38 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 12.5 mtt -108.24 166.6 10.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.63 -47.91 14.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.505 ' HB2' ' HB3' ' B' ' 5' ' ' SER . 4.0 mt-10 -117.11 3.68 12.71 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.448 ' HG2' ' HB2' ' B' ' 5' ' ' SER . 12.4 ptt180 -156.11 153.24 29.02 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.624 -0.83 . . . . 0.0 112.515 -177.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.998 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.78 121.43 52.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.09 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.08 153.74 37.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.913 0.387 . . . . 0.0 110.783 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.955 ' HB2' HD12 ' B' ' 24' ' ' LEU . 45.6 t90 -147.26 134.17 20.21 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.475 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -111.98 127.41 26.9 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.714 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.502 ' HG2' ' HB2' ' B' ' 38' ' ' LYS . 58.9 Cg_endo -75.05 142.69 28.0 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.461 2.107 . . . . 0.0 111.801 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -58.77 133.6 56.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.721 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.11 -5.81 75.66 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.398 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.502 ' HB2' ' HG2' ' B' ' 35' ' ' PRO . 1.7 mppt? -113.39 153.55 28.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -98.04 -11.94 22.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.3 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -118.66 152.9 35.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.081 0.467 . . . . 0.0 112.002 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.475 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 21.7 m-85 -81.19 122.8 27.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.6 p -91.58 -8.72 46.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.269 0.557 . . . . 0.0 110.328 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.684 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 15.2 mm -117.08 119.54 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.189 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.3 t -148.0 101.52 3.3 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.474 ' CD2' HG23 ' B' ' 43' ' ' ILE . 73.8 m-70 -124.87 137.72 54.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.004 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.485 ' HB2' ' OD2' ' B' ' 49' ' ' ASP . 21.6 mmm -86.53 140.27 30.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.645 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.7 m-85 -57.56 -23.08 48.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.846 0.355 . . . . 0.0 110.544 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.13 -20.48 61.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.968 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.579 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -98.55 -8.89 25.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.087 0.47 . . . . 0.0 110.318 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.693 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.7 mm -87.43 127.66 40.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.64 ' HG2' ' HB3' ' A' ' 410' ' ' ASP . 7.6 tttp -88.44 -46.67 8.95 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.548 0.689 . . . . 0.0 109.727 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.667 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.8 p -154.48 -177.9 6.78 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.145 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' GLN . . . . . 0.598 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 10.3 pt20 -144.18 143.34 31.04 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.717 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.002 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 25.7 mttp -113.08 153.04 28.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.501 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -130.06 127.04 62.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 176.202 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -87.51 120.0 70.95 Favored Pre-proline 0 C--O 1.249 1.041 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.51 172.94 12.41 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 124.864 3.709 . . . . 0.0 113.928 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -61.76 160.3 12.06 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.888 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.01 8.1 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.59 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 5.2 mttp -85.11 162.96 19.06 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.26 -5.85 46.76 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.308 0.575 . . . . 0.0 110.478 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.984 ' HE2' ' HG3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -146.86 157.73 43.73 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.373 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.611 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -96.64 134.44 34.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.563 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 97.4 mt-30 -135.5 163.24 30.52 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.596 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -141.83 153.22 44.34 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 113.547 -1.66 . . . . 0.0 107.377 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.002 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -146.54 139.68 25.58 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 119.052 0.842 . . . . 0.0 111.256 178.742 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.998 HD11 HD13 ' B' ' 31' ' ' ILE . 96.2 mt -94.23 104.58 16.58 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.77 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.667 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.5 t -91.36 111.71 24.28 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.482 HD22 HD13 ' B' ' 50' ' ' ILE . 5.2 mt -94.23 157.57 15.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.579 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -79.02 -4.77 51.73 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.423 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.8 -5.61 53.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.636 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.6 20.69 50.45 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' ASP . . . . . 0.409 ' HB3' HD12 ' B' ' 69' ' ' LEU . 20.9 t70 -125.91 158.78 34.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.354 -0.423 . . . . 0.0 110.415 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.552 HG22 ' HA ' ' B' ' 68' ' ' VAL . 16.1 p -137.5 131.14 31.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.836 0.351 . . . . 0.0 110.316 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.539 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.13 101.09 10.6 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.062 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.51 137.92 32.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.207 0.527 . . . . 0.0 111.719 -178.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.684 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 53.2 m-85 -122.77 111.46 16.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.899 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.593 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.5 t-80 -88.43 104.14 16.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.132 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.596 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 58.4 m-85 -75.09 100.22 4.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.14 -2.02 47.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.579 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.2 t-20 -79.78 91.29 5.31 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.27 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.86 -37.77 9.32 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 52.4 m -53.85 -59.42 4.65 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.534 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.6 p -127.57 9.94 6.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -176.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.512 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.41 -48.9 7.17 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.549 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.1 -51.87 67.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.983 0.421 . . . . 0.0 110.87 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.534 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 7.6 mttt -67.48 -34.92 78.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.053 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.661 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.9 mt-10 -64.64 -46.86 80.73 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.234 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.611 ' HD3' HG23 ' B' ' 63' ' ' ILE . 25.3 ttp180 -53.83 -47.73 70.63 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.88 -46.47 87.7 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.6 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.08 -42.39 89.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 118.137 0.426 . . . . 0.0 111.164 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.97 HG13 HD11 ' B' ' 26' ' ' LEU . 47.9 t -60.95 -43.87 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.598 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.3 ttpm? -59.52 -55.21 37.49 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.843 178.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.75 -54.12 42.65 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.908 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.733 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.5 tp -61.99 -38.36 88.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.807 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.411 HD12 HG12 ' B' ' 92' ' ' VAL . 24.7 mt -70.58 -43.31 69.66 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 97' ' ' GLN . . . . . 0.408 ' N ' HE22 ' B' ' 53' ' ' GLN . 37.3 mt-30 -63.69 -21.13 66.23 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 122.158 0.98 . . . . 0.0 109.051 178.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -84.15 -50.59 7.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.159 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.733 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.4 mt -78.62 -46.68 18.71 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -176.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.693 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.2 mt -49.86 -60.07 5.74 Favored Pre-proline 0 N--CA 1.468 0.443 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -176.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.87 -13.88 37.46 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.17 1.913 . . . . 0.0 113.828 -178.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 18.9 mtmm -87.78 -6.34 58.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.433 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -127.18 -28.18 2.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.63 ' HE2' ' HB3' ' B' ' 100' ' ' LEU . 7.5 pttt -94.92 170.06 9.7 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.31 0.576 . . . . 0.0 111.364 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.86 128.6 20.43 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 178.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.473 ' HA ' ' OD1' ' A' ' 410' ' ' ASP . 8.5 mtpm? -46.5 149.71 0.75 Allowed 'General case' 0 C--N 1.327 -0.39 0 O-C-N 124.174 0.922 . . . . 0.0 112.528 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.27 4.53 38.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.322 1.058 . . . . 0.0 108.504 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 41.8 t30 . . . . . 0 C--O 1.251 1.179 0 CA-C-N 113.065 -1.88 . . . . 0.0 108.159 179.75 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.433 ' HD1' HG12 ' A' ' 393' ' ' VAL . 5.5 p90 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 393' ' ' VAL . . . . . 0.433 HG12 ' HD1' ' A' ' 392' ' ' TYR . 5.9 p -61.54 -43.48 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 120.855 0.36 . . . . 0.0 110.867 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -89.32 70.34 2.45 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.63 ' OE2' ' HE2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 75.4 157.42 0.19 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.591 0.756 . . . . 0.0 110.096 -178.281 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.533 ' O ' ' HE3' ' B' ' 19' ' ' LYS . 3.2 t70 -130.19 31.24 4.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.637 -178.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.506 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 0.8 OUTLIER -57.48 -42.18 82.14 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.562 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 7.7 tt0 172.86 -62.01 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.671 0.607 . . . . 0.0 111.119 178.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.946 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.8 tt0 -154.58 90.69 1.34 Allowed 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.457 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -132.24 93.09 3.2 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.441 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.508 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.9 p-10 -138.42 -45.34 0.5 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.618 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -74.12 13.37 0.56 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.723 0.773 . . . . 0.0 110.645 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 1.028 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.52 123.93 17.89 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.547 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -112.09 128.72 56.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.773 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.583 ' HG2' ' HG2' ' B' ' 54' ' ' LYS . 3.3 mt-10 -72.34 -76.32 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.819 0.342 . . . . 0.0 110.882 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 73.08 3.9 4.79 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.956 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 407' ' ' ASP . . . . . 0.857 ' HB3' ' HB2' ' B' ' 52' ' ' CYS . 22.5 t70 -111.17 -1.66 16.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.81 0.814 . . . . 0.0 108.985 178.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.439 ' HB3' ' H ' ' A' ' 409' ' ' ASP . 0.4 OUTLIER 51.45 -139.21 0.99 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.054 -1.43 . . . . 0.0 113.047 179.027 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.439 ' H ' ' HB3' ' A' ' 408' ' ' GLU . 0.1 OUTLIER -109.38 -163.66 0.88 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.977 -178.714 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.492 ' HB3' ' HD2' ' B' ' 104' ' ' LYS . 2.1 p30 . . . . . 0 C--O 1.253 1.271 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.978 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.4 tpt . . . . . 0 N--CA 1.481 1.087 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ALA . . . . . 0.661 ' HB2' ' HB2' ' B' ' 40' ' ' ARG . . . -111.28 178.05 4.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.73 -0.214 . . . . 0.0 110.609 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.49 53.17 1.5 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.141 0.496 . . . . 0.0 111.352 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -153.57 109.88 3.33 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 21.0 m -152.02 47.07 0.77 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.992 0.425 . . . . 0.0 110.823 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.419 ' HB2' ' HB3' ' B' ' 27' ' ' MET . 16.5 mp0 -90.51 -175.33 4.42 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.433 ' O ' ' HA ' ' B' ' 27' ' ' MET . 6.0 tp10 -63.51 113.69 3.45 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.773 0.32 . . . . 0.0 110.837 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 80.2 t -82.93 115.44 25.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.035 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.474 ' HB2' HD21 ' B' ' 95' ' ' LEU . 48.5 mt -94.94 -29.06 14.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.393 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.41 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.7 tp -142.61 138.32 30.66 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.8 mt -121.57 121.59 64.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.1 t -112.06 149.21 14.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.819 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.551 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.71 178.16 4.56 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.977 -179.63 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.525 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 12.7 mtpt 17.94 74.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 O-C-N 125.344 1.653 . . . . 0.0 113.727 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 13' ' ' LYS . 50.2 t -119.28 121.61 66.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.773 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.624 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 95.6 mtt180 -89.26 135.73 33.42 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.193 0.521 . . . . 0.0 111.464 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -130.57 106.53 8.56 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.63 ' HE2' ' OE2' ' A' ' 395' ' ' GLU . 0.5 OUTLIER 63.49 49.97 2.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.033 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.533 ' HE3' ' O ' ' A' ' 396' ' ' ASP . 0.7 OUTLIER 70.7 25.6 4.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.205 178.754 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.522 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.8 tt0 -134.96 119.5 18.07 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.089 -0.244 . . . . 0.0 111.212 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.64 153.31 43.62 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.47 -157.95 19.51 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.314 -0.469 . . . . 0.0 112.474 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -129.33 132.18 47.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.833 0.349 . . . . 0.0 110.334 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.901 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -97.43 130.95 44.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.029 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -124.05 128.43 49.33 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.872 HD11 HG13 ' B' ' 92' ' ' VAL . 22.2 mt -108.47 118.01 35.67 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.433 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.2 mpt? -98.65 165.22 11.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.026 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.8 -50.65 44.11 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.309 -0.86 . . . . 0.0 113.226 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -104.49 -3.75 23.57 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 167.2 30.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 119.421 -0.912 . . . . 0.0 112.704 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.805 HD12 HD11 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -115.9 125.66 73.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.664 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -129.92 119.02 22.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.236 0.541 . . . . 0.0 111.424 -178.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.901 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.8 t90 -112.05 133.82 53.98 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.002 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.483 ' HB2' ' CD2' ' B' ' 41' ' ' PHE . . . -115.67 135.28 22.64 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.231 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.828 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -74.1 150.84 43.52 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.576 2.184 . . . . 0.0 111.617 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -61.32 133.22 55.62 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.182 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.91 8.92 86.06 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.805 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.828 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.37 146.58 39.23 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.45 -0.441 . . . . 0.0 110.505 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 39' ' ' ASP . . . . . 0.465 ' OD2' ' HD2' ' B' ' 40' ' ' ARG . 2.4 p-10 -94.99 0.39 54.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.473 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.661 ' HB2' ' HB2' ' B' ' 2' ' ' ALA . 0.0 OUTLIER -136.39 151.65 49.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.104 0.478 . . . . 0.0 111.785 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.531 ' HD1' ' HB3' ' B' ' 2' ' ' ALA . 35.5 m-85 -82.24 121.77 27.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.393 -0.821 . . . . 0.0 108.94 178.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.2 p -86.5 -19.8 28.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.162 0.506 . . . . 0.0 110.3 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.789 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 49.5 mm -108.63 110.68 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.803 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 7.5 t -137.69 101.6 4.51 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 79.9 m80 -129.13 144.24 51.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.045 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.468 ' O ' HG12 ' B' ' 50' ' ' ILE . 76.6 mmm -88.58 143.94 26.63 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.711 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -61.82 -18.97 61.95 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.89 -15.02 60.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.506 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.603 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.69 -6.02 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 109.983 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.663 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.9 mm -90.42 129.23 41.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.471 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 11.2 ttpt -86.32 -33.44 20.6 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.24 0.543 . . . . 0.0 109.825 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.857 ' HB2' ' HB3' ' A' ' 407' ' ' ASP . 27.5 p -178.38 -178.16 0.6 Allowed 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.089 -0.96 . . . . 0.0 108.638 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' GLN . . . . . 0.443 ' OE1' HD12 ' B' ' 100' ' ' LEU . 5.4 pm0 -134.89 140.94 46.18 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.996 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.091 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 47.1 mttp -102.2 145.29 29.62 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.353 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.528 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -124.15 129.39 74.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.099 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 176.677 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.494 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -90.17 117.52 68.12 Favored Pre-proline 0 C--O 1.251 1.138 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.59 173.03 10.49 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 125.165 3.91 . . . . 0.0 114.441 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.7 mp0 -61.12 160.48 10.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.069 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.76 -28.94 8.13 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.946 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.8 mttp -87.79 152.8 21.84 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.65 -20.34 66.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.228 0.537 . . . . 0.0 110.322 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.735 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.1 OUTLIER -135.48 144.0 46.15 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.923 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.658 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -85.44 142.36 13.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.54 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 95.5 mt-30 -141.01 163.51 32.78 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.421 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -141.96 153.46 44.34 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.039 -1.437 . . . . 0.0 108.04 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.091 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.71 146.03 30.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 119.045 0.839 . . . . 0.0 110.678 178.18 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.805 HD11 HD12 ' B' ' 31' ' ' ILE . 55.7 mt -97.19 106.65 19.01 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.149 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.592 ' HA ' HG22 ' B' ' 74' ' ' THR . 14.1 t -91.72 124.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.45 HD22 HD13 ' B' ' 50' ' ' ILE . 5.5 mt -108.08 153.91 22.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.022 0.439 . . . . 0.0 112.151 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.603 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -76.06 -5.48 46.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.768 0.794 . . . . 0.0 108.977 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.2 -4.64 48.67 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.6 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.26 20.68 51.77 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.465 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' ASP . . . . . 0.447 ' HB3' HD12 ' B' ' 69' ' ' LEU . 23.5 t70 -126.2 160.47 30.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.561 -0.32 . . . . 0.0 110.509 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.592 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.8 p -141.65 131.22 23.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.048 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.577 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 10.5 m -110.21 104.17 12.96 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.106 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.4 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 7.5 m-20 -82.26 153.58 25.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.235 0.54 . . . . 0.0 112.206 -178.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.789 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 64.5 m-85 -140.02 111.31 7.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.857 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.624 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.78 112.01 21.29 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.731 ' HE2' ' HB3' ' B' ' 88' ' ' GLU . 20.6 m-85 -76.91 92.52 3.66 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.067 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.2 9.16 34.88 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.525 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 52.2 t30 -84.76 92.75 8.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.03 0.443 . . . . 0.0 110.238 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -49.85 -32.0 13.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.678 -178.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.99 -60.63 3.02 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -178.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.481 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.7 p -128.27 14.19 6.67 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.707 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.96 -46.02 10.85 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.412 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.56 -54.52 33.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.481 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -64.66 -37.64 88.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.229 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.731 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 14.2 mt-10 -65.5 -45.17 84.61 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.278 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.658 ' HD3' HG23 ' B' ' 63' ' ' ILE . 19.2 ttp180 -54.99 -47.02 75.18 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.03 -44.96 95.59 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 113.536 -1.665 . . . . 0.0 112.568 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.93 -42.09 81.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 117.841 0.291 . . . . 0.0 111.073 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.872 HG13 HD11 ' B' ' 26' ' ' LEU . 34.0 t -62.41 -42.21 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.17 -56.2 25.18 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.579 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.09 -52.59 63.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.087 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.724 ' HG ' HD12 ' B' ' 99' ' ' LEU . 15.1 tp -61.96 -42.54 99.24 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.038 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.491 HD12 HG12 ' B' ' 92' ' ' VAL . 19.1 mt -68.23 -43.47 77.88 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.73 -21.31 65.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.361 1.077 . . . . 0.0 109.347 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.42 -50.93 6.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.164 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.724 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.8 mt -74.28 -50.88 17.08 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 113.452 -1.704 . . . . 0.0 114.675 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.711 HD23 ' HB3' ' B' ' 47' ' ' TYR . 40.5 mt -49.87 -57.53 12.12 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.613 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 62.2 Cg_exo -54.84 -16.92 12.51 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.614 2.209 . . . . 0.0 114.076 -179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -87.52 -13.65 42.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.754 0.312 . . . . 0.0 110.945 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.509 ' O ' ' HD3' ' B' ' 105' ' ' ARG . 70.4 m-85 -121.37 -29.85 4.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.793 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' B' ' 100' ' ' LEU . 52.9 pttt -85.03 124.8 32.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.203 0.525 . . . . 0.0 111.158 -179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 105' ' ' ARG . . . . . 0.509 ' HD3' ' O ' ' B' ' 103' ' ' PHE . 0.0 OUTLIER -150.83 116.03 5.35 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.873 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -64.83 -37.87 89.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.712 0.291 . . . . 0.0 111.551 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -143.23 61.78 1.39 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.782 0.325 . . . . 0.0 111.001 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 0.999 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.475 ' HB2' ' H ' ' A' ' 393' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 393' ' ' VAL . . . . . 0.475 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 6.4 m -67.4 142.05 17.05 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 82.16 -67.31 3.71 Favored Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.791 ' HG2' ' H ' ' B' ' 76' ' ' ASN . 2.9 tp10 -108.1 95.99 6.06 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.111 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -98.22 29.66 3.45 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.37 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.504 ' HA ' ' HD3' ' B' ' 19' ' ' LYS . 12.2 t70 -41.3 -43.03 2.33 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.493 ' HB3' ' H ' ' A' ' 399' ' ' GLU . 3.1 tt0 175.19 -96.13 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.921 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.1 tt0 -117.54 99.71 7.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.463 -177.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.509 ' HB2' ' CD2' ' A' ' 403' ' ' PHE . 9.4 p-10 -135.64 92.1 2.79 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.351 0.596 . . . . 0.0 112.241 -177.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.518 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.3 p-10 -139.48 -46.99 0.46 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -73.14 11.56 0.7 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.786 0.803 . . . . 0.0 110.44 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.888 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -55.49 116.14 2.71 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.39 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -100.57 131.04 46.69 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.645 ' HA ' ' HA ' ' B' ' 54' ' ' LYS . 2.5 tt0 -81.12 -69.93 0.57 Allowed 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -177.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 85.64 -27.42 0.09 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.765 0.826 . . . . 0.0 109.01 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 407' ' ' ASP . . . . . 0.493 ' HB3' ' CB ' ' B' ' 52' ' ' CYS . 0.2 OUTLIER -79.39 -36.25 39.48 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 176.484 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.437 ' HB3' ' H ' ' A' ' 409' ' ' ASP . 0.5 OUTLIER 62.41 -159.92 0.31 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 113.83 -1.532 . . . . 0.0 112.792 177.179 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' A' ' 408' ' ' GLU . 40.8 t0 -76.27 69.5 2.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.759 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.495 ' OXT' ' HE3' ' B' ' 106' ' ' LYS . 26.4 t70 . . . . . 0 C--O 1.243 0.744 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.751 ' HG3' ' HB2' ' B' ' 6' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.938 0 CA-C-O 120.364 0.126 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.8 -146.28 0.14 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.889 0.376 . . . . 0.0 110.692 -179.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.79 78.16 8.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.618 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 13.3 m 66.08 52.9 1.13 Allowed 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 121.553 0.692 . . . . 0.0 110.441 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 14.7 m -148.93 105.38 3.53 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.412 -0.813 . . . . 0.0 108.874 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.751 ' HB2' ' HG3' ' B' ' 1' ' ' MET . 70.3 mm-40 72.59 36.4 0.99 Allowed 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -178.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.592 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -89.12 101.72 14.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.25 -179.784 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 95.5 t -82.01 115.88 25.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.048 0.451 . . . . 0.0 110.246 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.426 ' HB2' HD21 ' B' ' 95' ' ' LEU . 25.7 mt -97.53 -29.75 13.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.841 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.0 tp -139.5 140.4 37.2 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 79.4 mt -122.59 121.94 64.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.775 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.3 t -111.96 148.21 15.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.929 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.597 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.03 175.68 5.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.556 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.1 79.68 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 O-C-N 125.393 1.683 . . . . 0.0 113.61 -179.62 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.597 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.6 t -130.74 126.98 61.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 114.878 -1.056 . . . . 0.0 108.957 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.591 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 9.2 mtm180 -95.16 144.87 25.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.608 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.8 110.33 6.68 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.424 ' NZ ' ' HA ' ' A' ' 395' ' ' GLU . 13.0 tppt? 67.82 52.19 0.74 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.627 0.727 . . . . 0.0 110.003 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.504 ' HD3' ' HA ' ' A' ' 397' ' ' ASP . 0.3 OUTLIER 62.89 25.28 14.99 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.869 178.107 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.555 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.6 pt20 -138.32 131.72 30.49 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.98 -0.45 . . . . 0.0 110.263 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.418 ' HA ' ' HA ' ' B' ' 16' ' ' ARG . 2.1 t70 -82.72 153.52 25.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -177.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.11 -154.77 12.42 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.914 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 136.65 50.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.085 0.469 . . . . 0.0 110.077 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.941 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.44 141.79 30.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.938 -178.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 40.2 m-85 -133.19 122.54 24.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.857 HD11 HG13 ' B' ' 92' ' ' VAL . 19.6 mt -104.34 120.67 41.71 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.8 -178.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.592 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.3 mpt? -100.99 161.61 13.47 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.093 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.19 -20.41 65.39 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -107.78 -20.2 13.29 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -161.9 167.67 24.28 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.824 -176.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.855 HD13 HD11 ' B' ' 67' ' ' LEU . 1.1 tt -109.65 117.71 55.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -119.05 152.65 36.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.969 0.414 . . . . 0.0 110.752 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.941 ' HB2' HD12 ' B' ' 24' ' ' LEU . 38.3 t90 -147.32 140.78 25.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.408 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -125.51 138.16 31.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.944 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' B' ' 34' ' ' ALA . 12.5 Cg_exo -68.33 153.6 73.89 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.644 2.229 . . . . 0.0 111.374 179.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -65.23 116.01 6.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.964 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.96 4.1 54.48 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.432 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.549 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -97.36 143.22 28.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.582 0.706 . . . . 0.0 111.253 179.762 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.63 -14.29 52.28 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.494 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.42 156.81 45.23 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.939 0.399 . . . . 0.0 111.463 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -75.69 131.49 39.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.187 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -92.61 -28.93 16.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.442 0.639 . . . . 0.0 109.752 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.784 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 16.7 mm -97.57 123.84 50.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.404 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 31.2 t -147.99 101.45 3.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.486 ' CD2' HG23 ' B' ' 43' ' ' ILE . 85.0 m-70 -124.61 128.74 49.35 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.67 0.272 . . . . 0.0 110.816 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.529 ' O ' HG12 ' B' ' 50' ' ' ILE . 0.0 OUTLIER -78.96 139.72 38.17 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.869 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.565 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -58.84 -24.32 61.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.65 -8.74 57.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.57 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.71 ' HA ' ' HE2' ' B' ' 70' ' ' HIS . 0.9 OUTLIER -111.63 -10.14 14.12 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.282 0.563 . . . . 0.0 110.289 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.652 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.1 mm -91.94 130.2 41.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.434 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 11.1 tttp -89.78 -46.25 8.72 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.435 0.636 . . . . 0.0 110.08 -179.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.541 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -155.95 -177.88 6.9 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.679 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' GLN . . . . . 0.409 ' HG2' ' HB3' ' B' ' 96' ' ' LEU . 1.5 pp0? -146.48 143.11 28.74 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.713 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.097 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 46.2 mttp -108.76 156.62 19.41 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.985 0.421 . . . . 0.0 110.123 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.533 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.9 OUTLIER -132.11 130.04 60.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 176.27 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.512 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.36 117.81 68.54 Favored Pre-proline 0 C--O 1.25 1.121 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.19 173.45 12.21 Favored 'Trans proline' 0 C--N 1.344 0.298 1 C-N-CA 125.357 4.038 . . . . 0.0 114.544 -177.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.68 160.56 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.09 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.85 -29.27 7.89 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.921 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.9 mttp -91.34 150.58 21.23 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.28 -4.24 21.03 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.134 0.492 . . . . 0.0 110.742 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.411 ' CE ' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -141.81 143.94 33.68 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.756 -179.397 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.644 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -90.55 136.62 23.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.512 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 78.6 mt-30 -138.17 163.35 31.9 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -141.09 154.03 45.74 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.184 -1.371 . . . . 0.0 107.964 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.097 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.71 143.67 28.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 118.927 0.785 . . . . 0.0 111.21 178.368 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.855 HD11 HD13 ' B' ' 31' ' ' ILE . 77.4 mt -96.02 109.77 22.12 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.138 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.583 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.7 t -95.41 108.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.499 HD22 HD13 ' B' ' 50' ' ' ILE . 4.1 mt -92.06 156.17 17.58 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.045 0.45 . . . . 0.0 112.008 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.71 ' HE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -80.18 1.13 29.44 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.347 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.49 -7.61 59.63 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.251 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.0 17.56 47.03 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.745 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.22 159.37 33.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.7 0.286 . . . . 0.0 110.711 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.583 HG22 ' HA ' ' B' ' 68' ' ' VAL . 20.8 p -135.35 130.86 35.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.885 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.536 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.18 102.42 11.56 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.367 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.791 ' H ' ' HG2' ' A' ' 395' ' ' GLU . 4.0 m-20 -82.22 142.72 31.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.465 0.65 . . . . 0.0 111.742 -178.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.784 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 52.2 m-85 -126.79 115.25 19.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.206 179.187 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.591 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.0 t60 -87.2 110.64 20.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.866 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.767 ' HE2' ' HB3' ' B' ' 88' ' ' GLU . 26.8 m-85 -81.56 93.23 6.66 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.1 4.02 52.86 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.556 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -81.79 91.27 6.47 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 121.212 0.53 . . . . 0.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.7 -39.95 5.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.423 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -59.64 4.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.192 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.472 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.1 p -127.61 10.43 6.64 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.47 -46.86 9.88 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.402 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.99 -53.88 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.84 0.352 . . . . 0.0 110.772 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 3.8 mttt -65.49 -35.89 82.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.057 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.767 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.5 mt-10 -65.37 -47.26 77.0 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.644 ' HD3' HG23 ' B' ' 63' ' ' ILE . 22.3 ttp180 -54.43 -47.57 72.66 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.015 0.912 . . . . 0.0 108.596 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.39 -45.73 91.8 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.662 -1.608 . . . . 0.0 112.357 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.14 -40.71 90.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.909 0.322 . . . . 0.0 110.998 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.857 HG13 HD11 ' B' ' 26' ' ' LEU . 40.9 t -62.92 -43.45 98.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 177.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.76 -55.38 35.88 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.588 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -53.46 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.463 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.868 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.7 tp -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.272 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.435 HD12 HG12 ' B' ' 92' ' ' VAL . 30.9 mt -71.01 -47.75 57.03 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 117.663 0.21 . . . . 0.0 110.981 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.41 -17.83 63.08 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.76 0.791 . . . . 0.0 109.757 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -88.3 -48.45 7.66 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.863 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.868 HD12 ' HG ' ' B' ' 95' ' ' LEU . 9.9 mt -79.29 -47.46 15.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.087 -1.415 . . . . 0.0 114.538 -177.053 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.652 HD22 ' HB ' ' B' ' 50' ' ' ILE . 26.5 mt -49.81 -53.88 37.74 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 17.4 Cg_endo -57.45 -18.52 31.94 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.332 2.021 . . . . 0.0 113.4 -179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -87.58 -8.52 56.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.715 0.293 . . . . 0.0 111.292 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -125.3 -6.01 7.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.328 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.561 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 75.3 mttt -59.43 109.08 0.81 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.985 0.421 . . . . 0.0 111.356 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 13.9 ptt-85 -80.74 63.98 5.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.35 0.595 . . . . 0.0 111.002 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.495 ' HE3' ' OXT' ' A' ' 410' ' ' ASP . 0.7 OUTLIER -115.0 145.41 42.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.189 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -102.16 20.06 17.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.145 0.497 . . . . 0.0 110.52 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.6 t30 . . . . . 0 C--O 1.245 0.851 0 CA-C-N 114.966 -1.016 . . . . 0.0 108.985 -179.856 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.421 ' N ' ' OD1' ' A' ' 396' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 14.7 p -170.24 142.2 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 70.33 -113.36 4.84 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.116 -0.793 . . . . 0.0 111.116 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.817 ' HG2' ' HB2' ' B' ' 76' ' ' ASN . 7.0 tp10 -100.46 144.44 29.45 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 392' ' ' TYR . 2.4 m-20 -135.27 29.63 3.33 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.138 -178.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.554 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 5.8 t70 -61.85 -33.93 75.06 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.437 -178.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.706 ' HB3' ' HZ1' ' B' ' 62' ' ' LYS . 1.6 tt0 169.77 -69.54 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 O-C-N 123.168 0.293 . . . . 0.0 111.364 178.275 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.627 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER -148.11 114.78 6.01 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.435 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 3.9 m-20 -139.83 87.48 2.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.52 ' C ' ' H ' ' A' ' 403' ' ' PHE . 1.3 p30 -138.45 -48.62 0.53 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -67.98 6.89 0.62 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.636 0.732 . . . . 0.0 110.637 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.949 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.56 120.3 7.52 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.766 179.107 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -104.94 131.72 52.08 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.78 -178.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 1.06 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 6.8 pt-20 -137.3 -166.38 1.92 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.225 0.536 . . . . 0.0 111.374 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -138.82 150.68 46.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.662 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -78.86 14.36 1.39 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.928 0.394 . . . . 0.0 111.458 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.459 ' HG3' ' HB3' ' B' ' 52' ' ' CYS . 5.2 pt-20 -50.61 98.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.808 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.72 -41.52 9.65 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 3.3 t0 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.825 178.608 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 7.7 tpt . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 121.162 0.506 . . . . 0.0 109.994 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.08 87.53 1.61 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.2 m 64.85 33.21 10.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 122.028 0.918 . . . . 0.0 108.565 -177.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -143.81 91.59 2.25 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.879 -178.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 4.1 m 61.32 74.77 0.43 Allowed 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.378 0.608 . . . . 0.0 109.536 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.52 2.42 11.23 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.96 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.643 ' CD ' ' H ' ' B' ' 7' ' ' GLU . 0.7 OUTLIER -81.92 101.64 10.38 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.315 -1.311 . . . . 0.0 109.769 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.3 t -82.36 116.27 26.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.126 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 34.7 mt -91.37 -33.3 15.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.181 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tp -131.21 127.48 37.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.992 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 71.1 mt -110.21 124.25 66.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.863 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.4 t -115.65 150.24 17.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.331 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.613 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -115.47 178.0 4.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.3 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.589 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.44 70.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 O-C-N 125.294 1.621 . . . . 0.0 113.245 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.613 HG23 ' O ' ' B' ' 13' ' ' LYS . 19.7 t -119.1 131.26 72.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.022 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.707 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 98.9 mtt180 -101.96 139.2 37.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.316 0.579 . . . . 0.0 111.301 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.568 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -134.84 109.57 8.61 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.968 -1.014 . . . . 0.0 108.728 179.039 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.95 41.43 6.58 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.477 0.485 . . . . 0.0 110.914 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.554 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 4.1 tptp 73.95 27.3 1.65 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.548 179.142 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.707 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 35.8 mt-30 -125.82 124.24 40.49 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -85.78 139.36 31.38 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.013 0.196 . . . . 0.0 110.798 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.575 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -172.96 -153.71 9.74 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.51 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.29 137.85 52.93 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.948 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.61 142.28 33.21 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.736 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -136.44 120.68 17.9 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.875 HD11 HG13 ' B' ' 92' ' ' VAL . 15.2 mt -100.27 120.66 40.26 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.636 -0.425 . . . . 0.0 111.28 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.57 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.6 mpt? -96.51 166.91 11.46 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.12 66.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -116.62 -0.89 12.28 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.463 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 16.8 ptt180 -157.13 158.69 36.81 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 119.158 -1.017 . . . . 0.0 112.699 -177.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 1.003 HD13 HD11 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -110.39 121.62 63.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.73 178.658 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.85 150.43 42.88 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.038 0.447 . . . . 0.0 110.662 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.948 ' HB2' HD12 ' B' ' 24' ' ' LEU . 31.1 t90 -146.99 139.83 25.1 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -131.1 137.52 30.88 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.575 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 22.1 Cg_exo -64.52 160.93 37.27 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.515 2.143 . . . . 0.0 111.515 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.44 131.26 50.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.191 0.519 . . . . 0.0 111.358 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.01 29.85 68.51 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.078 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 21.8 mmtm -113.7 147.55 37.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 117.023 0.412 . . . . 0.0 110.46 179.042 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -96.32 -14.65 22.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.044 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -124.02 146.7 48.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.45 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.421 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 45.4 m-85 -83.57 121.83 27.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.818 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 42' ' ' THR . . . . . 0.4 ' OG1' ' HD3' ' B' ' 35' ' ' PRO . 1.1 p -83.81 -21.13 32.2 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.262 0.553 . . . . 0.0 110.411 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.789 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 10.3 mm -106.28 124.39 61.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.56 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 42.3 t -147.78 101.45 3.32 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.827 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.516 ' CD2' HG23 ' B' ' 43' ' ' ILE . 73.4 m-70 -129.94 139.13 51.15 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.52 ' O ' HG12 ' B' ' 50' ' ' ILE . 79.6 mmm -92.4 142.77 27.06 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.698 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.7 m-85 -59.18 -21.3 59.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.25 0.548 . . . . 0.0 109.817 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' ALA . . . . . 0.594 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -68.38 -22.75 64.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.144 -0.935 . . . . 0.0 112.185 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.557 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -102.54 -10.92 18.91 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.999 0.428 . . . . 0.0 110.771 -179.426 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.678 ' HB ' HD22 ' B' ' 100' ' ' LEU . 0.9 OUTLIER -86.35 132.45 32.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.678 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -92.72 -55.34 3.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.609 0.719 . . . . 0.0 109.964 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.497 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -144.52 -177.45 5.5 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' GLN . . . . . 0.648 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 6.3 pt20 -141.87 145.85 35.1 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.694 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.069 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 49.3 mttp -107.16 147.05 30.59 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 177.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.732 ' HB ' ' HD3' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.92 123.46 62.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 176.365 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -88.97 120.27 69.94 Favored Pre-proline 0 C--O 1.245 0.868 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -69.53 172.69 11.96 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 124.415 3.41 . . . . 0.0 113.968 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.46 161.29 12.04 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.203 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.85 -28.96 7.75 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.627 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 6.4 mttp -85.24 161.36 19.6 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 175.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.02 -16.75 64.18 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.357 0.599 . . . . 0.0 110.496 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.706 ' HZ1' ' HB3' ' A' ' 398' ' ' GLU . 0.0 OUTLIER -140.05 150.37 44.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.415 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.603 ' O ' ' HB2' ' B' ' 79' ' ' PHE . 4.1 mp -89.11 135.09 26.73 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -134.35 162.95 30.79 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -175.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.756 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -140.0 153.62 46.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.968 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.069 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.45 145.51 30.24 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 119.232 0.924 . . . . 0.0 110.72 178.26 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 1.003 HD11 HD13 ' B' ' 31' ' ' ILE . 95.6 mt -94.74 109.08 21.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.421 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.536 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.0 t -95.36 108.72 21.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.53 HD22 HD13 ' B' ' 50' ' ' ILE . 5.2 mt -88.77 155.83 19.33 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.102 -177.267 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.557 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -79.23 -1.58 37.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.666 0.746 . . . . 0.0 109.034 178.294 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -5.91 58.71 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.584 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.5 20.45 44.65 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.556 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' ASP . . . . . 0.525 ' HB3' HD12 ' B' ' 69' ' ' LEU . 19.1 t70 -126.14 160.86 29.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.62 -0.29 . . . . 0.0 110.279 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.536 HG22 ' HA ' ' B' ' 68' ' ' VAL . 17.5 p -138.23 131.21 29.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.459 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.535 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.8 m -110.46 102.77 11.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.817 ' HB2' ' HG2' ' A' ' 395' ' ' GLU . 3.2 m-20 -82.99 144.63 29.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.552 0.691 . . . . 0.0 112.303 -177.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.789 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 46.5 m-85 -129.59 107.32 9.36 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.564 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.575 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.98 112.43 21.82 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.639 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.756 ' HE1' ' HB2' ' B' ' 65' ' ' LEU . 81.3 m-85 -83.56 95.98 8.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.92 5.47 51.56 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.27 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.589 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.4 t-20 -87.23 91.45 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.915 0.388 . . . . 0.0 110.015 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.06 -39.28 9.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.923 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.91 -59.44 4.33 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.53 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.61 10.41 6.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -44.99 -48.5 11.47 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.506 HG22 HG12 ' B' ' 63' ' ' ILE . 4.8 t -57.63 -52.14 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.15 0.5 . . . . 0.0 110.685 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.6 mttt -68.72 -33.63 74.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.61 ' HB3' ' CE2' ' B' ' 79' ' ' PHE . 11.3 mt-10 -65.79 -43.53 88.49 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.732 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 6.1 ttm105 -57.73 -43.71 85.51 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 177.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.22 -44.76 87.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.289 -1.323 . . . . 0.0 112.758 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.06 -45.11 74.77 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 117.784 0.266 . . . . 0.0 111.451 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.875 HG13 HD11 ' B' ' 26' ' ' LEU . 44.4 t -60.69 -43.19 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.648 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.4 ttpm? -59.27 -55.01 40.33 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.821 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -53.84 -54.33 39.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.474 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.637 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.2 tp -61.76 -41.71 98.05 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.349 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.488 HD12 HG12 ' B' ' 92' ' ' VAL . 22.1 mt -69.29 -44.62 71.42 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 117.876 0.307 . . . . 0.0 110.221 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 97' ' ' GLN . . . . . 0.511 ' N ' HE22 ' B' ' 53' ' ' GLN . 48.1 tp60 -62.0 -24.28 66.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.233 1.016 . . . . 0.0 109.079 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.464 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 2.0 mm-40 -84.97 -44.76 12.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.299 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.67 HD13 ' CE2' ' B' ' 47' ' ' TYR . 20.4 mt -81.06 -47.07 14.05 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.698 HD23 ' HB3' ' B' ' 47' ' ' TYR . 34.6 mt -50.15 -56.77 15.64 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -176.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 52.4 Cg_exo -57.09 -22.32 46.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.407 2.071 . . . . 0.0 114.094 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.464 ' HD3' ' O ' ' B' ' 98' ' ' GLN . 12.2 mtpt -88.53 -10.93 47.2 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.594 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 71.4 m-85 -127.08 7.94 6.64 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.677 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.53 ' O ' ' HD2' ' B' ' 104' ' ' LYS . 0.0 OUTLIER -55.05 128.23 32.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.17 0.509 . . . . 0.0 112.034 -179.127 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 41.0 mtt-85 58.85 21.35 8.97 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.302 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.437 ' HE3' ' HB3' ' B' ' 106' ' ' LYS . 0.7 OUTLIER -83.23 78.89 9.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.972 0.415 . . . . 0.0 110.147 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -81.18 55.28 2.48 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.958 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.075 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.516 ' CE2' ' HB3' ' A' ' 396' ' ' ASP . 5.2 t80 . . . . . 0 N--CA 1.476 0.864 0 CA-C-O 121.392 0.615 . . . . 0.0 110.316 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 50.7 t -132.75 115.87 25.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 81.83 -57.67 4.93 Favored Glycine 0 N--CA 1.45 -0.405 0 N-CA-C 109.829 -1.309 . . . . 0.0 109.829 -177.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.604 ' HG2' ' HB2' ' B' ' 76' ' ' ASN . 7.8 tp10 -111.95 148.31 34.02 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.56 ' C ' ' H ' ' A' ' 398' ' ' GLU . 3.3 p30 -109.16 30.14 6.86 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.714 -0.221 . . . . 0.0 111.5 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.535 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 0.8 OUTLIER -64.3 16.88 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.641 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.56 ' H ' ' C ' ' A' ' 396' ' ' ASP . 47.1 mt-10 96.16 -77.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.606 1.562 . . . . 0.0 111.906 178.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.918 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.0 OUTLIER -108.97 143.85 37.7 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.316 -177.807 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 400' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 177.7 77.12 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.052 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.555 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.04 -54.2 0.58 Allowed 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -177.621 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 402' ' ' ASP . . . . . 0.416 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 3.9 p30 -69.9 11.5 0.29 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.728 0.775 . . . . 0.0 110.555 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 1.013 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.53 126.28 25.85 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.858 179.352 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -112.92 122.34 47.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.714 -178.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.592 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 3.2 pt-20 -107.28 -29.96 9.0 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.065 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 64.7 t30 79.23 -37.02 0.18 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.769 0.828 . . . . 0.0 110.545 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -78.6 -35.21 46.04 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.403 ' HB2' ' H ' ' A' ' 409' ' ' ASP . 5.9 mm-40 51.84 -103.04 0.14 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.316 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.403 ' H ' ' HB2' ' A' ' 408' ' ' GLU . 1.1 t0 -178.82 152.71 0.61 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.492 -0.776 . . . . 0.0 108.93 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 27.7 t70 . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.659 -0.686 . . . . 0.0 109.769 -179.23 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.492 ' H2 ' ' CD ' ' B' ' 7' ' ' GLU . 77.7 mtm . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 120.512 0.196 . . . . 0.0 111.019 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.23 127.75 0.35 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.28 51.97 0.57 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.351 0.596 . . . . 0.0 111.586 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -158.38 -47.24 0.06 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.309 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 14.8 m -155.28 154.66 32.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.321 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 67.82 42.77 1.88 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.464 0.65 . . . . 0.0 110.374 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.492 ' CD ' ' H2 ' ' B' ' 1' ' ' MET . 1.4 tp10 -106.32 122.72 46.81 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.37 178.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' B' ' 27' ' ' MET . 49.0 t -82.89 121.8 36.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 115.217 -0.902 . . . . 0.0 111.605 -177.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.1 mt -97.37 -30.39 12.96 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.476 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 8.5 tp -131.76 127.31 36.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.837 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 75.8 mt -111.78 121.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.825 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -111.21 149.9 13.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.215 -179.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.586 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.65 176.94 4.86 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.841 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.546 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.0 mtpm? 18.17 72.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 O-C-N 125.352 1.657 . . . . 0.0 113.527 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.586 HG23 ' O ' ' B' ' 13' ' ' LYS . 18.6 t -119.83 124.52 72.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.577 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.581 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 4.8 mtp180 -89.19 120.21 30.37 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.179 0.514 . . . . 0.0 111.252 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.631 ' HG2' HG13 ' B' ' 43' ' ' ILE . 28.1 tp60 -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.21 37.57 2.08 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.529 ' HD3' ' HA ' ' A' ' 397' ' ' ASP . 0.0 OUTLIER 68.24 23.81 7.68 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.336 179.882 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.539 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 54.0 tt0 -126.21 120.77 30.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.326 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.57 153.29 43.03 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.758 0.313 . . . . 0.0 111.808 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.43 ' HA2' ' N ' ' B' ' 36' ' ' GLU . . . 178.08 -154.9 15.83 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.783 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.98 132.87 49.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.997 0.427 . . . . 0.0 110.387 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -99.01 143.13 29.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.54 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -134.28 124.42 25.85 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.951 HD11 HG13 ' B' ' 92' ' ' VAL . 17.3 mt -105.13 110.17 22.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.349 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.439 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.2 mpt? -89.46 162.58 15.66 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.47 -23.64 62.9 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -116.23 -12.56 11.16 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -159.57 166.64 30.34 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 119.703 -0.799 . . . . 0.0 112.73 -176.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 1.031 HD13 HD11 ' B' ' 67' ' ' LEU . 1.1 tt -112.21 119.41 60.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.835 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -120.16 151.89 38.44 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.328 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.889 ' HB2' HD12 ' B' ' 24' ' ' LEU . 27.1 t90 -146.9 139.77 25.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -124.76 143.87 44.94 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.274 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.537 ' O ' ' HB2' ' B' ' 38' ' ' LYS . 28.3 Cg_exo -61.85 159.95 31.28 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.476 2.118 . . . . 0.0 111.662 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.43 ' N ' ' HA2' ' B' ' 22' ' ' GLY . 5.3 tp10 -57.34 130.52 46.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.21 0.529 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.0 29.81 75.75 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.031 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.15 151.28 31.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.056 0.428 . . . . 0.0 110.843 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -98.65 -22.08 16.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.013 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.405 ' H ' ' HG2' ' B' ' 40' ' ' ARG . 6.5 ptp180 -108.67 140.92 41.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.651 -178.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -84.74 124.59 31.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.011 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.4 p -92.58 -13.65 29.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.281 0.562 . . . . 0.0 110.594 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.739 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -114.09 124.89 71.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.135 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.0 t -147.81 102.84 3.45 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -124.5 137.41 54.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.488 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.7 mmm -89.16 138.89 31.02 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.694 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.7 m-85 -56.97 -24.39 52.82 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.301 0.572 . . . . 0.0 110.358 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.27 -32.65 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.614 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.571 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -91.58 -11.87 36.0 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 123.538 0.524 . . . . 0.0 111.604 -178.272 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.626 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.5 mm -83.57 135.69 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.413 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 18.0 ttpp -87.18 -47.69 8.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 4.7 p -167.73 -177.77 3.6 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.318 -1.31 . . . . 0.0 108.273 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -135.05 144.04 47.05 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.616 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.013 ' HD3' ' HB3' ' A' ' 403' ' ' PHE . 48.1 mttp -102.16 148.31 25.56 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.535 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -125.78 127.84 71.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 176.542 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.434 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.9 p -91.3 115.62 64.78 Favored Pre-proline 0 C--O 1.25 1.111 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 59.7 Cg_endo -67.6 173.14 9.36 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 125.125 3.883 . . . . 0.0 114.042 -177.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -59.28 160.05 7.01 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.123 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.52 -29.05 8.13 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.534 -1.427 . . . . 0.0 109.534 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.596 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 5.1 mttm -86.9 153.18 21.81 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.37 -16.21 64.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.242 0.544 . . . . 0.0 110.493 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.918 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.31 138.38 38.31 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.926 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.63 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -80.34 131.61 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.54 162.91 30.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -176.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.689 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -140.38 153.89 46.52 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.068 -1.424 . . . . 0.0 107.719 177.121 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.005 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -145.7 142.43 28.98 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.973 0.806 . . . . 0.0 110.483 178.176 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 1.031 HD11 HD13 ' B' ' 31' ' ' ILE . 39.8 mt -94.0 106.94 18.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.024 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.515 HG21 ' OE2' ' A' ' 405' ' ' GLU . 8.1 t -94.24 113.84 29.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.042 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.542 HD22 HD13 ' B' ' 50' ' ' ILE . 3.2 mt -98.36 158.9 15.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.021 0.439 . . . . 0.0 112.066 -177.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.571 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -81.18 0.02 38.38 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.297 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.67 -3.47 56.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.531 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.91 19.96 56.68 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' ASP . . . . . 0.42 ' HB3' HD12 ' B' ' 69' ' ' LEU . 18.9 t70 -126.04 157.41 38.01 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.559 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 20.3 p -137.15 130.86 31.74 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.524 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 0.8 OUTLIER -107.96 105.34 15.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.157 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.604 ' HB2' ' HG2' ' A' ' 395' ' ' GLU . 5.2 m-20 -86.36 128.46 34.94 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 112.534 -177.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.739 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 50.3 m-85 -114.32 110.03 19.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.397 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.581 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.5 t-160 -86.82 113.35 22.56 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.026 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.689 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 46.0 m-85 -80.18 92.33 5.68 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.31 27.66 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.926 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.546 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -107.14 91.33 3.61 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -35.51 4.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.19 -0.914 . . . . 0.0 113.337 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 57.1 m -58.88 -59.99 4.57 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.516 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.8 p -127.9 9.99 6.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.596 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -42.8 -50.15 5.68 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 113.863 1.061 . . . . 0.0 113.863 -177.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.462 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.92 -52.79 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.909 0.385 . . . . 0.0 110.992 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.516 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -66.73 -35.49 80.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.138 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.643 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.3 mt-10 -64.97 -45.46 85.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.63 ' HD3' HG23 ' B' ' 63' ' ' ILE . 20.6 ttp180 -55.22 -47.51 75.24 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.5 -45.27 93.77 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.799 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.7 -42.44 82.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 117.843 0.292 . . . . 0.0 111.26 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.951 HG13 HD11 ' B' ' 26' ' ' LEU . 45.8 t -62.36 -42.26 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -53.46 58.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.69 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 94' ' ' ASP . . . . . 0.419 ' HA ' ' HG2' ' B' ' 97' ' ' GLN . 2.9 m-20 -57.82 -54.65 44.46 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.045 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.824 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -60.67 -40.33 91.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.137 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.493 HD12 HG12 ' B' ' 92' ' ' VAL . 22.7 mt -69.72 -45.86 67.24 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.729 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 97' ' ' GLN . . . . . 0.419 ' HG2' ' HA ' ' B' ' 94' ' ' ASP . 19.4 pt20 -65.03 -18.39 65.26 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.745 0.783 . . . . 0.0 109.544 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.448 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 33.4 mm-40 -84.79 -50.86 7.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.981 178.442 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.824 HD12 ' HG ' ' B' ' 95' ' ' LEU . 9.3 mt -78.41 -45.91 21.18 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.694 HD23 ' HB3' ' B' ' 47' ' ' TYR . 32.7 mt -51.58 -51.23 71.58 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -176.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 45.4 Cg_endo -67.36 -24.96 42.57 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.198 1.932 . . . . 0.0 114.341 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 32.3 mttm -63.82 -31.67 72.93 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.003 0.43 . . . . 0.0 111.804 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -91.79 17.19 9.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.665 0.745 . . . . 0.0 110.485 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.407 ' HD3' ' O ' ' B' ' 100' ' ' LEU . 14.4 mptt -112.55 -177.84 3.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.775 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 105' ' ' ARG . . . . . 0.575 ' HA ' ' HE ' ' B' ' 105' ' ' ARG . 0.0 OUTLIER -89.02 46.59 1.4 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.196 0.522 . . . . 0.0 110.748 179.841 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -156.37 110.85 2.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.599 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.13 119.04 7.08 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.546 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.519 -0.753 . . . . 0.0 109.859 -179.488 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.529 ' HE2' ' HB2' ' A' ' 395' ' ' GLU . 2.6 p90 . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.642 0.258 . . . . 0.0 110.457 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 21.1 t -94.89 99.97 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.157 0.503 . . . . 0.0 109.8 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 170.56 -45.33 0.2 Allowed Glycine 0 CA--C 1.505 -0.531 0 N-CA-C 109.444 -1.463 . . . . 0.0 109.444 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.529 ' HB2' ' HE2' ' A' ' 392' ' ' TYR . 0.0 OUTLIER -117.16 169.35 9.52 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 177.187 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.42 ' O ' ' HE3' ' B' ' 19' ' ' LYS . 32.1 t70 -136.1 31.86 2.93 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.298 -178.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.652 ' HA ' ' HA ' ' B' ' 18' ' ' LYS . 32.1 t70 -60.35 -42.57 96.03 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.602 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.832 ' HB2' ' HZ3' ' B' ' 62' ' ' LYS . 0.5 OUTLIER 165.25 -84.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.161 0.984 . . . . 0.0 108.582 179.016 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.45 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 5.3 pt-20 -125.99 109.53 12.55 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 176.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.492 ' HB3' ' HE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.5 87.19 2.24 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.17 -176.799 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.526 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -138.75 -50.31 0.54 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.287 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.33 13.63 0.42 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.546 0.688 . . . . 0.0 110.264 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.92 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.62 127.51 31.74 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.144 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -99.65 131.51 45.6 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.896 -178.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.909 ' HB2' ' HG2' ' B' ' 54' ' ' LYS . 8.7 tt0 -136.33 132.93 36.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.683 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 406' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 405' ' ' GLU . 2.4 t30 175.58 45.63 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 123.986 0.804 . . . . 0.0 109.504 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 407' ' ' ASP . . . . . 0.401 ' OD2' ' HG2' ' B' ' 97' ' ' GLN . 10.1 t0 -77.76 -35.37 51.8 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.35 -170.02 0.21 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.714 -179.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.558 ' HA ' ' NZ ' ' B' ' 51' ' ' LYS . 40.9 t0 -175.07 57.98 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.213 176.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 4.9 t70 . . . . . 0 C--O 1.255 1.354 0 CA-C-N 114.264 -1.335 . . . . 0.0 109.118 -179.85 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.652 ' HG2' ' HB1' ' B' ' 28' ' ' ALA . 3.0 ptm . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 120.296 0.093 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.86 -50.6 9.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.985 0.421 . . . . 0.0 110.644 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 6.0 m -130.27 -30.71 1.92 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.255 0.55 . . . . 0.0 110.349 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 53.4 m -151.26 -153.36 0.48 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.062 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 5.2 m -116.66 169.74 9.12 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 66.13 25.25 10.79 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.654 0.596 . . . . 0.0 110.581 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' B' ' 27' ' ' MET . 91.2 mt-10 -74.09 101.41 3.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.478 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.6 t -82.75 106.54 13.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.443 ' HB2' HD21 ' B' ' 95' ' ' LEU . 19.5 mt -88.28 -28.85 20.82 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.486 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.411 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -135.61 136.85 41.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.9 mt -121.66 120.14 60.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.797 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.5 t -110.89 150.02 13.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.463 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.548 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.1 mtmp? -116.4 175.89 5.35 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.406 -178.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.48 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.3 OUTLIER 17.87 70.9 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.679 0 O-C-N 125.346 1.654 . . . . 0.0 113.293 -178.527 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.548 HG23 ' O ' ' B' ' 13' ' ' LYS . 11.7 t -114.92 121.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.073 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.575 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 73.4 mtp85 -92.49 120.92 33.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.414 HE21 ' HB3' ' B' ' 17' ' ' GLN . 0.6 OUTLIER -113.27 103.37 11.25 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 178.311 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.652 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 57.5 mttp 63.76 56.44 1.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.076 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.547 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 0.3 OUTLIER 68.51 21.23 8.19 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.765 177.983 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tt0 -133.7 122.6 23.61 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.831 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.03 153.44 43.2 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.92 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.668 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 177.98 -170.75 43.13 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 116.148 -0.478 . . . . 0.0 112.706 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 131.74 54.04 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.938 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.31 139.1 33.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.542 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' TYR . . . . . 0.457 ' CD2' ' HE1' ' B' ' 41' ' ' PHE . 71.3 m-85 -132.7 122.75 25.08 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.908 HD11 HG13 ' B' ' 92' ' ' VAL . 14.0 mt -102.11 116.43 32.66 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.458 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.553 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 1.8 mpt? -93.99 162.45 13.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.652 ' HB1' ' HG2' ' B' ' 1' ' ' MET . . . -62.44 -8.76 6.66 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.494 ' HG3' ' HB3' ' B' ' 1' ' ' MET . 5.3 mp0 -127.9 -16.13 4.7 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -158.24 160.5 37.19 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.439 -176.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 1.018 HD13 HD11 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.37 118.66 53.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.968 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.416 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -119.14 154.17 33.69 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.415 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.938 ' HB2' HD12 ' B' ' 24' ' ' LEU . 55.2 t90 -146.87 129.42 15.96 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.401 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -109.96 121.82 40.77 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.312 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.445 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 40.3 Cg_endo -69.03 139.46 42.82 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.469 2.112 . . . . 0.0 111.833 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.668 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.0 mt-10 -57.92 132.04 52.22 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.628 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.09 -7.48 64.53 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.141 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -113.37 152.94 29.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.583 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -97.55 -7.32 31.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.36 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -124.24 152.02 43.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.109 0.48 . . . . 0.0 111.938 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.457 ' HE1' ' CD2' ' B' ' 25' ' ' TYR . 44.8 m-85 -81.16 121.81 26.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.901 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 12.7 p -91.46 -9.85 43.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 110.111 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.79 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 19.0 mm -117.34 119.99 63.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.159 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 27.7 t -148.04 101.43 3.29 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.482 ' CD2' HG23 ' B' ' 43' ' ' ILE . 66.0 m-70 -125.99 132.95 51.93 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.49 ' O ' HG12 ' B' ' 50' ' ' ILE . 50.9 mtp -86.6 143.38 27.68 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.676 ' HB3' HD23 ' B' ' 100' ' ' LEU . 19.9 m-85 -59.92 -22.09 61.97 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.195 0.521 . . . . 0.0 109.959 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.86 -3.31 31.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.707 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.559 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 12.4 m-20 -118.78 -9.99 10.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.252 0.549 . . . . 0.0 110.105 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.804 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.3 mm -92.39 127.7 44.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.558 ' NZ ' ' HA ' ' A' ' 409' ' ' ASP . 29.1 tttp -87.15 -49.49 7.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.477 0.656 . . . . 0.0 110.069 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.08 -177.43 5.91 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.188 -178.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' GLN . . . . . 0.43 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 24.3 pt20 -144.49 146.78 32.6 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.969 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.086 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 39.3 mttp -109.06 146.18 34.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 177.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.536 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -125.11 128.54 73.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 176.211 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -90.87 118.66 68.77 Favored Pre-proline 0 C--O 1.25 1.105 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -178.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.55 173.03 13.14 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 125.196 3.931 . . . . 0.0 114.017 -177.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -61.35 160.24 11.12 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.79 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.84 -28.97 8.09 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -177.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 3.6 mttm -87.41 164.78 16.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.44 -14.96 57.86 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.314 0.578 . . . . 0.0 109.924 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.832 ' HZ3' ' HB2' ' A' ' 398' ' ' GLU . 0.0 OUTLIER -133.46 129.79 37.72 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.445 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.442 HG21 ' HA ' ' B' ' 86' ' ' VAL . 2.7 mp -77.98 129.6 37.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 177.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -135.67 163.63 29.71 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.701 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.8 tp -138.84 153.43 48.34 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 113.069 -1.878 . . . . 0.0 106.906 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.086 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.32 140.98 26.83 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 119.07 0.85 . . . . 0.0 110.33 178.336 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 1.018 HD11 HD13 ' B' ' 31' ' ' ILE . 94.3 mt -94.02 111.22 22.91 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.444 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.621 ' HA ' HG22 ' B' ' 74' ' ' THR . 15.0 t -95.73 102.83 14.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.719 HD22 HD13 ' B' ' 50' ' ' ILE . 1.3 mt -84.06 152.89 24.11 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.942 -176.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.559 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 1.6 p-80 -81.38 6.4 14.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.695 0.759 . . . . 0.0 109.004 178.294 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.82 -22.04 46.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.226 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.93 4.51 24.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.184 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' ASP . . . . . 0.522 ' OD2' HD12 ' B' ' 69' ' ' LEU . 4.5 p-10 -126.65 175.95 7.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.075 0.464 . . . . 0.0 111.807 -179.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.621 HG22 ' HA ' ' B' ' 68' ' ' VAL . 14.2 p -136.85 146.83 46.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -179.242 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.545 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 18.6 m -122.24 103.47 8.79 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.108 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.541 ' HB2' ' HB2' ' A' ' 397' ' ' ASP . 6.8 m-20 -81.98 150.86 27.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.265 0.555 . . . . 0.0 112.273 -178.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.79 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.5 m-85 -137.34 117.85 13.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.31 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.644 ' HB2' ' HZ1' ' B' ' 62' ' ' LYS . 4.5 t-160 -92.15 113.69 26.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.708 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.701 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 65.2 m-85 -83.7 93.16 7.86 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.71 3.48 53.84 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.48 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.9 t-20 -85.1 91.19 8.05 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.09 -41.9 2.76 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.427 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.35 -59.84 3.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 20.8 p -127.78 7.93 6.25 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -176.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.506 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -41.1 -52.89 3.17 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.442 ' HA ' HG21 ' B' ' 63' ' ' ILE . 2.2 t -57.67 -49.11 81.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.544 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 5.8 mptt -70.06 -31.95 69.82 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.636 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.2 mt-10 -65.92 -44.1 86.15 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.482 ' HD2' HD12 ' B' ' 55' ' ' ILE . 23.4 ttp180 -56.51 -47.56 79.05 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 90' ' ' ASP . . . . . 0.672 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -63.39 -44.69 93.98 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.38 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.13 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.884 0.311 . . . . 0.0 111.424 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.908 HG13 HD11 ' B' ' 26' ' ' LEU . 57.0 t -59.81 -45.11 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.672 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.6 tmmt? -58.55 -54.56 45.72 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.007 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.07 -54.43 30.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.101 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.872 ' HG ' HD12 ' B' ' 99' ' ' LEU . 14.8 tp -65.29 -30.6 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.025 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.449 HD12 HG12 ' B' ' 92' ' ' VAL . 24.0 mt -76.18 -42.58 45.91 Favored 'General case' 0 C--O 1.216 -0.676 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 97' ' ' GLN . . . . . 0.401 ' HG2' ' OD2' ' A' ' 407' ' ' ASP . 26.4 mt-30 -60.81 -24.52 65.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.379 1.085 . . . . 0.0 108.745 178.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.98 -46.62 11.86 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.551 -1.659 . . . . 0.0 111.363 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.872 HD12 ' HG ' ' B' ' 95' ' ' LEU . 11.5 mt -86.78 -28.11 23.18 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -176.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.804 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.3 mt -67.57 -58.64 8.15 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.051 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.0 -21.67 72.81 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.888 1.725 . . . . 0.0 112.993 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.522 ' HG2' ' HA ' ' B' ' 99' ' ' LEU . 3.8 ptmm? -87.91 2.2 52.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.598 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.475 ' HD2' ' O ' ' B' ' 99' ' ' LEU . 11.2 m-85 -127.66 -34.76 2.18 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -31.36 114.49 0.13 Allowed 'General case' 0 N--CA 1.477 0.889 0 O-C-N 124.031 0.832 . . . . 0.0 112.924 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 23.0 ttm105 -70.54 -30.57 67.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.892 -1.049 . . . . 0.0 112.457 -177.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.475 ' HZ2' ' HB2' ' B' ' 70' ' ' HIS . 0.0 OUTLIER -146.3 158.64 43.9 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.734 -0.387 . . . . 0.0 111.019 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -91.11 150.27 21.46 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.962 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 1.02 0 O-C-N 124.088 0.868 . . . . 0.0 111.27 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.9 p90 . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 27.7 t -67.3 127.59 29.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 94.54 -79.48 0.92 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -92.06 123.37 35.37 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 398' ' ' GLU . 6.2 p-10 -89.23 -1.39 58.06 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.386 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.604 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 3.5 t70 -70.25 15.83 0.08 Allowed 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.22 0.464 . . . . 0.0 111.938 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.604 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 0.8 OUTLIER 98.85 -93.1 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.343 1.457 . . . . 0.0 112.147 178.523 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.734 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 20.9 tt0 -123.7 117.88 25.97 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 122.058 0.143 . . . . 0.0 111.259 -178.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.566 ' HB3' ' HE2' ' A' ' 403' ' ' PHE . 5.1 m-20 -150.35 82.58 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.6 p-10 -139.01 -42.31 0.47 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.18 15.83 0.15 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.72 0.771 . . . . 0.0 110.93 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 1.088 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -55.86 132.31 49.21 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.693 179.307 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -115.45 127.79 55.58 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.369 -178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.845 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 4.2 pt-20 -136.61 147.82 47.15 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -135.76 59.53 1.71 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.481 0.658 . . . . 0.0 111.219 -179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 407' ' ' ASP . . . . . 0.493 ' CB ' ' HB3' ' B' ' 52' ' ' CYS . 8.8 t70 -112.95 -24.86 9.27 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.921 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.23 -99.62 0.09 Allowed 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.231 -179.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.52 ' OD1' ' HE3' ' B' ' 106' ' ' LYS . 35.9 t70 -145.99 77.65 1.5 Allowed 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.734 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' B' ' 106' ' ' LYS . 31.3 t70 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.169 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 67.08 29.83 7.71 Favored 'General case' 0 C--O 1.232 0.176 0 O-C-N 123.891 0.745 . . . . 0.0 110.149 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.7 m -78.97 81.26 5.26 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.675 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 6.6 m 69.46 -93.74 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.36 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 35.8 m -159.95 167.1 28.78 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 67.1 26.57 8.84 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.965 0.791 . . . . 0.0 111.389 178.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.431 ' O ' ' HA ' ' B' ' 27' ' ' MET . 27.1 tt0 -104.1 116.92 33.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.044 0.449 . . . . 0.0 110.864 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 90.9 t -82.78 120.73 34.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.126 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.414 ' HB2' HD21 ' B' ' 95' ' ' LEU . 45.3 mt -94.73 -30.36 14.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.618 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.0 tp -136.64 135.11 38.01 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 77.8 mt -118.55 119.55 61.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.722 HG21 HD23 ' B' ' 24' ' ' LEU . 2.8 t -108.46 148.64 12.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.812 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.572 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.11 173.59 6.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.114 -178.627 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 17.75 68.24 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 O-C-N 125.163 1.539 . . . . 0.0 114.214 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.572 HG23 ' O ' ' B' ' 13' ' ' LYS . 24.4 t -117.08 126.85 74.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.649 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 12.0 mtt180 -99.18 133.64 43.18 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.36 0.6 . . . . 0.0 111.65 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.543 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 38.5 tp60 -111.21 107.47 16.8 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.53 46.53 1.84 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.733 0.778 . . . . 0.0 109.264 -179.12 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.35 23.64 9.18 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.896 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.618 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.2 tt0 -122.16 119.19 30.57 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.381 -0.199 . . . . 0.0 110.776 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.498 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 1.2 m-20 -58.85 146.66 36.56 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.709 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 178.67 -169.39 40.89 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.082 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.28 137.2 53.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.979 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.48 137.79 35.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.917 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 25' ' ' TYR . . . . . 0.416 ' CD1' ' HE2' ' B' ' 41' ' ' PHE . 68.6 m-85 -131.96 117.4 18.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.784 HD11 HG13 ' B' ' 92' ' ' VAL . 12.3 mt -100.42 119.12 37.98 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.501 -178.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.431 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.3 mpt? -95.44 161.85 13.9 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -20.43 63.14 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.54 -22.2 11.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -178.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.507 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 1.6 ptp180 -155.28 160.86 41.11 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.713 -0.795 . . . . 0.0 112.592 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.911 HD12 HD11 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -104.0 122.15 56.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 114.81 -1.086 . . . . 0.0 108.282 179.028 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.403 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -125.84 155.37 41.27 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.182 0.515 . . . . 0.0 111.29 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.979 ' HB2' HD12 ' B' ' 24' ' ' LEU . 50.4 t90 -147.23 134.69 20.83 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.904 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -117.67 133.77 23.27 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.033 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 1.005 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 2.3 Cg_endo -77.14 146.38 25.35 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.377 2.051 . . . . 0.0 111.923 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.709 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 34.3 mt-10 -64.01 129.46 40.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.297 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.45 -0.02 61.35 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.439 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 1.005 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.9 mptt -113.42 154.37 27.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.322 . . . . 0.0 110.768 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -100.94 4.72 42.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.451 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -140.03 157.17 46.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.209 0.528 . . . . 0.0 111.895 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.416 ' HE2' ' CD1' ' B' ' 25' ' ' TYR . 61.2 m-85 -85.21 126.05 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.756 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.7 p -93.07 -19.07 21.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.263 0.554 . . . . 0.0 110.381 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.704 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 37.1 mm -110.71 118.63 57.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.23 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 43.6 t -147.8 101.33 3.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -126.36 138.82 53.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.785 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.512 ' O ' HG12 ' B' ' 50' ' ' ILE . 18.9 mmt -84.33 144.23 28.98 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.676 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.8 m-85 -61.45 -20.6 63.3 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.962 0.41 . . . . 0.0 110.564 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.59 -11.36 60.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.436 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.541 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.05 -11.56 15.28 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.204 0.526 . . . . 0.0 109.655 179.277 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.682 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.2 mm -91.38 131.0 39.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.43 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 34.7 tttm -87.83 -43.38 11.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.359 0.6 . . . . 0.0 109.745 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.505 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.9 p -164.94 -177.59 4.75 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.261 -0.882 . . . . 0.0 109.602 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.67 142.2 41.13 Favored 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.126 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.088 ' HD3' ' HB3' ' A' ' 403' ' ' PHE . 50.2 mttp -105.28 150.89 24.76 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.55 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.95 129.39 71.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.826 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.463 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -93.41 121.49 64.97 Favored Pre-proline 0 C--O 1.252 1.21 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -68.15 172.89 10.29 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 125.071 3.847 . . . . 0.0 114.53 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -63.44 160.43 16.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.39 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.75 -29.19 7.97 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.734 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 22.7 mttp -88.47 155.2 19.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.47 -17.69 63.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.974 0.416 . . . . 0.0 110.991 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.607 ' HD3' ' CE1' ' B' ' 78' ' ' HIS . 17.3 pttt -132.47 134.21 44.78 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.731 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.604 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -78.84 134.9 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.63 ' OE1' ' HD3' ' B' ' 60' ' ' LYS . 0.2 OUTLIER -134.0 163.04 30.43 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 118.085 -1.446 . . . . 0.0 114.811 -176.165 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.428 ' HA ' ' O ' ' B' ' 54' ' ' LYS . 2.2 tp -141.95 153.51 44.38 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 113.111 -1.859 . . . . 0.0 107.24 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.033 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.53 141.71 28.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 118.93 0.787 . . . . 0.0 110.52 178.567 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.911 HD11 HD12 ' B' ' 31' ' ' ILE . 96.1 mt -93.83 100.28 12.49 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.884 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.642 ' HA ' HG22 ' B' ' 74' ' ' THR . 11.4 t -86.15 111.88 21.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.467 HD12 ' HB3' ' B' ' 73' ' ' ASP . 6.4 mt -94.26 156.6 16.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.998 0.428 . . . . 0.0 111.543 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.541 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -80.16 -1.4 40.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.248 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.28 -3.96 56.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.542 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.11 19.41 53.23 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.54 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' ASP . . . . . 0.467 ' HB3' HD12 ' B' ' 69' ' ' LEU . 21.7 t70 -125.96 158.9 34.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.254 . . . . 0.0 110.533 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.642 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.5 p -137.87 131.05 30.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.234 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.547 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.6 m -107.39 103.42 12.76 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.464 ' ND2' ' HB2' ' B' ' 66' ' ' GLN . 0.9 OUTLIER -82.69 143.85 30.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.072 0.463 . . . . 0.0 112.162 -177.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.704 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 41.6 m-85 -126.64 127.26 44.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.222 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.649 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.5 t-160 -92.37 101.3 13.77 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.178 -178.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.708 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 24.8 m-85 -79.37 99.52 7.19 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.79 9.9 24.69 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.8 91.43 7.05 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.636 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.83 -41.94 1.69 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.451 -178.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -59.75 4.78 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.452 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.7 p -127.79 7.34 6.18 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 115.747 1.758 . . . . 0.0 115.747 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.708 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.73 -47.33 7.87 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.4 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.76 -51.44 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 111.084 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.452 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.5 mptt -69.06 -34.26 74.88 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.053 0.454 . . . . 0.0 109.858 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.687 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.9 mt-10 -64.83 -44.42 89.9 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.604 ' HD3' HG23 ' B' ' 63' ' ' ILE . 24.0 ttp180 -54.91 -47.18 74.7 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 122.052 0.929 . . . . 0.0 108.509 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 90' ' ' ASP . . . . . 0.603 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.51 -45.37 93.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.27 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.54 79.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.689 0.222 . . . . 0.0 111.411 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.784 HG13 HD11 ' B' ' 26' ' ' LEU . 46.8 t -61.69 -41.54 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.603 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.0 OUTLIER -59.87 -58.47 8.42 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.545 177.915 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.7 -51.42 63.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.937 -1.028 . . . . 0.0 112.31 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.765 ' HG ' HD12 ' B' ' 99' ' ' LEU . 15.5 tp -62.04 -42.61 99.36 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.844 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.461 HD12 HG12 ' B' ' 92' ' ' VAL . 20.7 mt -68.89 -41.03 78.84 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -64.2 -23.45 67.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 122.094 0.95 . . . . 0.0 109.116 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -84.08 -50.82 7.6 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.237 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.765 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.3 mt -75.25 -49.86 17.95 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 113.47 -1.696 . . . . 0.0 115.103 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.682 HD22 ' HB ' ' B' ' 50' ' ' ILE . 54.6 mt -50.36 -58.41 9.89 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.608 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.9 Cg_exo -54.96 -20.71 23.96 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.19 1.927 . . . . 0.0 113.448 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -88.0 -6.79 57.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.764 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -120.97 -35.63 3.29 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.657 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 0.0 OUTLIER -96.77 145.56 25.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.956 0.407 . . . . 0.0 110.971 -179.629 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 105' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' B' ' 105' ' ' ARG . 0.3 OUTLIER -162.43 127.34 3.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.117 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.52 ' HE3' ' OD1' ' A' ' 409' ' ' ASP . 15.5 mtmm -91.34 -156.95 0.47 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.0 19.52 2.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.455 0.645 . . . . 0.0 109.719 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 3.0 t30 . . . . . 0 C--O 1.251 1.145 0 CA-C-N 114.491 -1.231 . . . . 0.0 108.502 -179.642 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.559 ' HB2' ' HA ' ' A' ' 398' ' ' GLU . 82.4 t80 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 111.288 0.107 . . . . 0.0 111.288 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 393' ' ' VAL . . . . . 0.499 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 86.7 t 80.16 123.68 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -178.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 83.91 -86.65 1.52 Allowed Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.481 ' HA ' ' OE1' ' A' ' 395' ' ' GLU . 4.2 tp10 -99.78 83.84 2.81 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.486 ' O ' ' HE2' ' B' ' 19' ' ' LYS . 0.1 OUTLIER -70.96 30.99 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 -176.159 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.707 ' HB3' ' OD1' ' A' ' 400' ' ' ASP . 8.8 t70 -72.58 -8.95 57.8 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 175.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.606 ' OE2' ' HA ' ' A' ' 398' ' ' GLU . 0.4 OUTLIER 100.18 -14.97 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.496 1.918 . . . . 0.0 114.93 175.609 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.818 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 51.0 tt0 -178.71 92.91 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 118.508 0.595 . . . . 0.0 109.991 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.707 ' OD1' ' HB3' ' A' ' 397' ' ' ASP . 3.5 m-20 -144.95 89.63 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.521 -177.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.507 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.0 -48.11 0.49 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -74.39 20.57 0.11 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.694 0.759 . . . . 0.0 111.18 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.655 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.4 OUTLIER -54.37 132.09 43.43 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.328 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -88.8 121.0 30.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.963 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.454 ' HB3' ' CD ' ' A' ' 408' ' ' GLU . 0.8 OUTLIER -91.25 157.48 17.13 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.024 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -165.41 -40.63 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 407' ' ' ASP . . . . . 0.551 ' HB2' ' OE1' ' B' ' 97' ' ' GLN . 18.6 t70 -91.08 -11.87 37.35 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -177.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.454 ' CD ' ' HB3' ' A' ' 405' ' ' GLU . 1.2 pm0 -58.99 117.04 4.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.1 0.476 . . . . 0.0 111.182 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.1 -95.02 0.09 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.591 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 21.2 t70 . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.265 -0.874 . . . . 0.0 109.327 179.695 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.182 0 CA-C-O 120.47 0.176 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.24 -43.41 3.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.325 0.584 . . . . 0.0 109.554 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.26 -169.34 1.44 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.636 178.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 9.3 m -56.88 111.16 0.95 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.763 0.316 . . . . 0.0 110.619 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 1.9 p -169.88 36.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.716 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.491 ' HB3' ' NH2' ' B' ' 30' ' ' ARG . 0.1 OUTLIER -176.64 31.2 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.347 0.594 . . . . 0.0 109.646 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.489 ' O ' ' HA ' ' B' ' 27' ' ' MET . 8.9 mp0 -60.93 122.4 14.81 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.388 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.457 HG11 HG12 ' B' ' 11' ' ' ILE . 63.7 t -82.18 108.94 15.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.746 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.41 ' HB2' HD21 ' B' ' 95' ' ' LEU . 31.8 mt -81.3 -33.8 32.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.623 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.401 ' CD2' HG22 ' B' ' 92' ' ' VAL . 6.2 tp -132.11 128.63 38.55 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.457 HG12 HG11 ' B' ' 8' ' ' VAL . 66.3 mt -111.64 122.0 65.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.847 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.6 t -113.57 149.89 15.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.612 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -116.71 179.32 4.04 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.666 -178.391 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 18.21 66.87 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 O-C-N 125.356 1.66 . . . . 0.0 113.491 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.612 HG23 ' O ' ' B' ' 13' ' ' LYS . 14.9 t -115.05 123.67 70.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.482 179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 54.3 mtt85 -97.44 122.34 40.37 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.233 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.7 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 22.4 tm0? -104.84 102.31 11.86 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.706 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 40.7 mttt 51.53 61.52 3.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.735 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.486 ' HE2' ' O ' ' A' ' 396' ' ' ASP . 0.0 OUTLIER 78.77 12.82 1.39 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 177.457 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.74 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 7.0 pt20 -130.52 125.88 35.41 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.393 0.997 . . . . 0.0 111.007 178.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -80.33 152.74 28.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -177.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.419 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . 175.68 -159.17 26.76 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.948 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.23 137.53 52.91 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.944 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.21 140.25 35.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.729 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' TYR . . . . . 0.436 ' CD2' ' HE2' ' B' ' 41' ' ' PHE . 55.4 m-85 -134.83 122.9 22.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.878 HD11 HG13 ' B' ' 92' ' ' VAL . 15.8 mt -103.18 118.01 35.83 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.564 -0.455 . . . . 0.0 111.797 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.489 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 1.8 mpt? -93.36 163.01 13.76 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.288 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.08 -21.98 60.07 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -115.25 -15.46 11.61 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.531 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -158.83 166.6 31.52 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 119.744 -0.782 . . . . 0.0 112.892 -177.007 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.863 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -110.23 122.46 64.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.912 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.471 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -124.14 152.81 42.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.085 0.469 . . . . 0.0 110.656 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.944 ' HB2' HD12 ' B' ' 24' ' ' LEU . 25.2 t90 -146.96 140.08 25.32 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -128.82 140.0 37.27 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.522 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.875 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 22.0 Cg_exo -64.02 158.48 47.39 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.625 2.217 . . . . 0.0 111.752 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.23 122.03 11.51 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.383 0.611 . . . . 0.0 111.967 -178.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.36 29.73 59.64 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.308 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.875 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.48 146.72 39.14 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.046 0.423 . . . . 0.0 110.295 178.837 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -92.91 -20.75 20.33 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.938 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -113.18 144.43 42.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.48 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.436 ' HE2' ' CD2' ' B' ' 25' ' ' TYR . 84.5 m-85 -85.74 122.43 29.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.727 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.82 -17.5 33.27 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.351 0.596 . . . . 0.0 110.278 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.707 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -112.64 119.86 61.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.153 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.0 t -148.0 101.45 3.29 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.479 ' CD2' HG23 ' B' ' 43' ' ' ILE . 61.6 m-70 -126.59 131.09 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.669 0.271 . . . . 0.0 110.282 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.531 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 67.8 mmm -83.36 143.12 30.54 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.646 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.87 -24.21 56.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.025 0.441 . . . . 0.0 110.571 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.16 -9.03 58.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.922 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.615 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 34.7 m-20 -109.92 -8.83 14.81 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.214 0.53 . . . . 0.0 110.039 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.556 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.0 OUTLIER -88.28 129.47 39.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.049 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.435 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 31.0 tttp -86.01 -38.72 17.6 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.657 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.3 p -167.24 178.81 5.39 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.513 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' GLN . . . . . 0.422 HE22 ' HG3' ' B' ' 93' ' ' LYS . 1.9 pp0? -142.41 135.82 28.91 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.416 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.006 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 34.0 mttm -105.79 155.5 19.23 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.001 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.541 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -128.12 129.99 69.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 176.453 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.42 122.37 63.05 Favored Pre-proline 0 C--O 1.25 1.107 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.661 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.21 172.89 11.3 Favored 'Trans proline' 0 C--O 1.235 0.342 1 C-N-CA 125.48 4.12 . . . . 0.0 114.657 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -65.14 160.41 21.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.824 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.42 -28.99 8.21 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.818 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 7.5 mttp -85.76 162.38 18.74 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.98 -17.73 60.49 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.114 0.483 . . . . 0.0 110.331 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.661 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 13.8 pttp -135.16 133.89 39.61 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.149 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.558 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.1 mp -79.58 129.91 36.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.649 ' HG2' ' HZ2' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -133.13 163.68 28.73 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -175.11 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.524 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -139.37 153.02 47.59 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 112.963 -1.926 . . . . 0.0 106.432 176.106 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.006 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.1 135.33 22.82 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 119.405 1.002 . . . . 0.0 111.545 179.408 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.863 HD11 HD13 ' B' ' 31' ' ' ILE . 76.7 mt -93.72 99.18 11.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.477 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.657 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.2 t -85.11 105.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.476 HD22 HD13 ' B' ' 50' ' ' ILE . 4.3 mt -89.88 155.7 18.97 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.146 0.498 . . . . 0.0 112.08 -177.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.615 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -81.4 4.32 21.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.718 0.771 . . . . 0.0 109.002 177.972 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -86.27 -5.84 59.1 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.206 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.46 13.96 56.33 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.095 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -126.27 155.14 42.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.761 0.315 . . . . 0.0 110.848 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.585 HG22 ' HA ' ' B' ' 68' ' ' VAL . 10.0 p -127.37 131.23 50.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.521 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.557 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.84 98.75 8.38 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.787 0.327 . . . . 0.0 110.16 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.485 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.7 m-20 -86.29 147.95 25.84 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.096 0.474 . . . . 0.0 111.381 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.707 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 61.4 m-85 -131.9 116.57 17.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.691 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.541 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.9 t-160 -86.95 103.48 15.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.61 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.684 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 51.2 m-85 -76.5 96.91 4.19 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.96 19.53 20.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.44 ' HA ' HD22 ' B' ' 81' ' ' ASN . 1.0 OUTLIER -90.91 93.6 9.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.291 0.567 . . . . 0.0 109.589 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.76 -32.64 0.63 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.01 -59.47 2.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.526 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.5 p -127.39 10.86 6.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -176.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.684 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.39 -52.1 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.442 HG22 HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.75 -50.58 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.691 0.281 . . . . 0.0 111.221 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.526 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.7 mttt -67.53 -33.63 75.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.648 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.1 mt-10 -64.63 -44.41 90.59 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.558 ' HD3' HG23 ' B' ' 63' ' ' ILE . 20.7 ttp180 -56.43 -47.1 79.79 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.68 -41.9 99.34 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.757 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.8 -41.47 78.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.614 0.188 . . . . 0.0 111.243 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.878 HG13 HD11 ' B' ' 26' ' ' LEU . 38.6 t -62.4 -43.53 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.422 ' HG3' HE22 ' B' ' 53' ' ' GLN . 0.5 OUTLIER -58.06 -52.79 64.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.096 178.061 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -57.16 -53.49 57.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.605 -179.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.802 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.3 tp -63.61 -36.98 85.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.008 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.8 mt -70.42 -45.1 66.56 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 110.43 -0.211 . . . . 0.0 110.43 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' GLN . . . . . 0.551 ' OE1' ' HB2' ' A' ' 407' ' ' ASP . 12.0 mm100 -62.43 -21.27 65.28 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.007 0.908 . . . . 0.0 109.461 178.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.34 -47.41 9.39 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.194 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.802 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.2 mt -81.44 -46.29 14.79 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -176.7 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.646 HD23 ' HB3' ' B' ' 47' ' ' TYR . 38.3 mt -52.38 -58.19 12.62 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.007 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.619 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 59.2 Cg_exo -54.68 -19.85 19.84 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.325 2.016 . . . . 0.0 113.829 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -84.88 -21.19 29.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 0.0 111.346 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -111.9 -17.76 12.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.659 0.266 . . . . 0.0 111.355 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -63.87 100.5 0.3 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.561 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' ARG . . . . . 0.452 ' HB3' ' OXT' ' B' ' 108' ' ' ASN . 6.3 mmp_? -128.86 -106.83 0.29 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.63 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp 70.73 -59.3 0.54 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.532 0.733 . . . . 0.0 112.338 178.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.13 20.94 17.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.214 0.53 . . . . 0.0 110.793 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.452 ' OXT' ' HB3' ' B' ' 105' ' ' ARG . 3.1 t-20 . . . . . 0 C--O 1.248 1.012 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.499 ' O ' ' HB ' ' A' ' 393' ' ' VAL . 2.2 p90 . . . . . 0 N--CA 1.482 1.144 0 CA-C-O 120.703 0.287 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 393' ' ' VAL . . . . . 0.499 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 87.2 t 78.14 121.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.028 0.531 . . . . 0.0 110.029 -179.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 85.32 -59.91 4.79 Favored Glycine 0 CA--C 1.509 -0.314 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -178.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.506 ' OE2' ' HG2' ' B' ' 18' ' ' LYS . 7.5 tp10 -116.57 102.77 9.76 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 176.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -123.83 31.48 5.85 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.461 -177.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.602 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 27.8 t70 -38.4 -36.34 0.23 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.542 ' HG3' ' NZ ' ' B' ' 19' ' ' LYS . 4.5 tt0 177.5 -82.18 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 177.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.88 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.5 tt0 -131.25 101.48 5.58 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -178.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.733 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -136.37 89.52 2.48 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 -176.199 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.0 p-10 -139.31 -46.6 0.46 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -72.92 9.37 1.18 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.24 0.543 . . . . 0.0 110.846 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.673 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -50.25 120.26 4.37 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.033 179.812 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -76.35 131.93 39.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.325 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.485 ' HB3' ' CD ' ' A' ' 408' ' ' GLU . 3.4 mt-10 -97.87 172.6 7.56 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.788 -178.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -162.02 -77.5 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.055 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 407' ' ' ASP . . . . . 0.76 ' HB2' ' HB3' ' B' ' 52' ' ' CYS . 0.8 OUTLIER -68.25 -57.55 5.81 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.255 0.55 . . . . 0.0 109.832 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.619 ' O ' ' HE3' ' B' ' 51' ' ' LYS . 0.0 OUTLIER 58.91 -115.98 0.82 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.067 179.428 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.509 ' HA ' ' CE ' ' B' ' 51' ' ' LYS . 17.6 t0 -82.7 53.95 2.53 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.565 0.697 . . . . 0.0 110.464 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.247 0.922 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.138 179.091 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.5 mmt . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 120.532 0.206 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.2 -31.62 0.69 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.704 0.288 . . . . 0.0 111.661 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.403 HG22 ' H ' ' B' ' 4' ' ' SER . 0.2 OUTLIER -115.37 175.61 5.44 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.929 -179.374 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.403 ' H ' HG22 ' B' ' 3' ' ' THR . 0.1 OUTLIER -81.66 -51.79 7.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.004 0.43 . . . . 0.0 110.693 179.634 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 9.9 m -96.87 97.25 9.13 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.096 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -124.55 -133.58 0.27 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.287 0.565 . . . . 0.0 110.592 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.431 ' OE1' ' HG ' ' B' ' 9' ' ' LEU . 0.0 OUTLIER -58.87 150.15 24.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.53 179.57 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 42.9 t -123.77 122.34 64.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 178.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.431 ' HG ' ' OE1' ' B' ' 7' ' ' GLU . 73.9 mt -91.09 -29.34 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.931 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.498 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -139.65 131.32 27.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 78.9 mt -115.05 122.68 69.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.859 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.7 t -114.33 150.34 16.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.647 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.7 mtmp? -114.8 177.22 4.73 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.488 -178.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.579 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.71 73.33 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 O-C-N 125.152 1.533 . . . . 0.0 113.343 -178.395 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.724 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.6 t -126.12 129.36 72.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.396 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.68 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 0.3 OUTLIER -99.6 145.19 27.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.053 0.454 . . . . 0.0 111.332 179.666 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.656 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -132.48 103.22 6.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.169 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.506 ' HG2' ' OE2' ' A' ' 395' ' ' GLU . 35.2 mttp 58.82 54.39 5.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.929 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.602 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 5.0 mptp? 72.19 23.99 3.22 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.898 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.68 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 36.9 mt-30 -126.29 119.63 27.88 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.559 ' HA ' ' HG3' ' B' ' 16' ' ' ARG . 0.8 OUTLIER -85.36 139.18 31.77 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.918 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -174.37 -151.06 8.07 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.753 -0.736 . . . . 0.0 113.589 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.3 140.18 52.38 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 122.73 0.412 . . . . 0.0 110.008 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.943 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -102.03 145.7 28.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.471 -178.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -139.33 112.77 8.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.735 0.303 . . . . 0.0 110.357 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.983 HD11 HG13 ' B' ' 92' ' ' VAL . 12.1 mt -90.27 137.23 32.51 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.13 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.532 ' HB3' ' NH2' ' B' ' 30' ' ' ARG . 42.8 mtt -120.8 167.19 12.77 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.028 -178.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.14 -49.76 8.89 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -122.75 11.59 9.76 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.458 -178.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.578 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.0 OUTLIER -159.6 156.4 27.92 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.253 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 1.024 HD13 HD11 ' B' ' 67' ' ' LEU . 1.5 tt -111.59 122.01 65.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -120.17 150.84 40.0 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.983 0.42 . . . . 0.0 110.775 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.943 ' HB2' HD12 ' B' ' 24' ' ' LEU . 48.2 t90 -146.99 141.2 26.19 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.868 ' HB1' ' HD3' ' B' ' 38' ' ' LYS . . . -139.6 129.46 14.11 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.56 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.918 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 21.1 Cg_endo -62.87 167.42 12.1 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.873 2.382 . . . . 0.0 112.489 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.54 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 72.4 mt-10 -81.65 124.0 29.19 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.479 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 118.36 -30.29 6.07 Favored Glycine 0 C--O 1.228 -0.281 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.766 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.868 ' HD3' ' HB1' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -75.14 171.73 13.64 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.499 0.666 . . . . 0.0 111.762 -179.943 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 39' ' ' ASP . . . . . 0.519 ' OD1' ' HG3' ' B' ' 40' ' ' ARG . 18.1 p-10 -115.74 -23.07 8.84 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.168 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.519 ' HG3' ' OD1' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -117.72 149.54 40.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.368 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.526 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 50.5 m-85 -70.32 154.61 41.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.576 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.8 p -115.48 -43.3 3.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.258 0.552 . . . . 0.0 109.801 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.656 HG13 ' HG3' ' B' ' 17' ' ' GLN . 18.6 mm -91.44 121.21 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.931 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 23.0 t -147.64 101.39 3.33 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.42 ' CD2' HG23 ' B' ' 43' ' ' ILE . 77.5 m-70 -125.94 138.78 53.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.919 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 78.8 mmm -88.85 143.75 26.68 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.569 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -58.12 -20.73 42.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.304 0.573 . . . . 0.0 109.802 178.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' ALA . . . . . 0.502 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -72.81 -18.52 61.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.81 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.63 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.79 -6.36 21.53 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 123.46 0.475 . . . . 0.0 110.232 -179.731 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.59 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.6 mm -90.37 130.58 39.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.619 ' HE3' ' O ' ' A' ' 408' ' ' GLU . 31.8 tttp -91.06 -44.41 9.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.488 0.661 . . . . 0.0 110.427 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.76 ' HB3' ' HB2' ' A' ' 407' ' ' ASP . 1.2 p -158.25 -177.31 6.46 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.497 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' B' ' 96' ' ' LEU . 5.0 pt20 -145.3 148.77 33.8 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.793 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.087 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 42.2 mttm -117.03 154.11 31.5 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 176.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.696 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -130.22 128.72 64.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.801 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.6 p -88.81 119.8 69.99 Favored Pre-proline 0 C--O 1.249 1.042 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.155 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.76 173.54 13.79 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 125.255 3.97 . . . . 0.0 114.275 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -59.45 160.93 6.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.127 178.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.18 -29.25 7.79 Favored Glycine 0 C--N 1.317 -0.477 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -177.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.88 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.5 mttp -89.51 153.14 21.03 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.29 -3.36 16.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.249 0.547 . . . . 0.0 110.64 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.81 154.26 45.09 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.288 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.628 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -99.85 135.23 36.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -137.79 162.95 32.58 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.844 -1.142 . . . . 0.0 113.991 -177.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.644 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.4 tp -139.92 153.66 47.01 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.276 177.13 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.087 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -143.87 141.3 30.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.938 0.79 . . . . 0.0 111.278 178.742 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 1.024 HD11 HD13 ' B' ' 31' ' ' ILE . 64.7 mt -97.77 103.78 15.75 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.145 178.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.669 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.8 t -87.16 105.91 15.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.562 HD22 HD13 ' B' ' 50' ' ' ILE . 3.4 mt -91.18 158.1 16.81 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.012 -177.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.63 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.15 -1.68 45.47 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.162 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.76 -10.69 59.67 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.475 -1.238 . . . . 0.0 110.314 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.84 12.86 48.75 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.058 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -126.33 158.14 36.61 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.964 0.412 . . . . 0.0 110.929 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.669 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.9 p -128.59 131.6 48.17 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.6 m -104.37 105.34 15.44 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.359 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.733 HD21 ' HB3' ' A' ' 400' ' ' ASP . 5.0 m-20 -82.29 136.97 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.363 0.602 . . . . 0.0 111.956 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.422 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.1 m-85 -121.63 110.85 16.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.598 178.232 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.724 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.8 t60 -86.53 99.1 11.44 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.658 -1.155 . . . . 0.0 111.804 -177.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.644 ' HE1' ' HB2' ' B' ' 65' ' ' LEU . 71.6 m-85 -77.26 94.24 4.11 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 178.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.18 1.54 39.17 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.579 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -79.99 91.38 5.44 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.86 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.82 -39.68 2.59 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.6 -59.62 4.36 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.523 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.4 p -127.81 9.0 6.35 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -176.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.526 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.23 -50.71 6.4 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.4 -51.91 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.82 0.343 . . . . 0.0 110.811 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.523 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.3 mttt -66.6 -35.17 79.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.874 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.653 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -63.35 -46.54 86.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.104 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.636 ' HD2' HD12 ' B' ' 55' ' ' ILE . 22.2 ttp180 -55.73 -48.47 75.14 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 90' ' ' ASP . . . . . 0.536 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -61.56 -44.66 96.62 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.052 -1.431 . . . . 0.0 112.502 -179.627 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -43.19 76.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.89 0.314 . . . . 0.0 111.097 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.983 HG13 HD11 ' B' ' 26' ' ' LEU . 58.0 t -60.8 -43.57 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.696 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.2 tmmt? -60.37 -55.9 27.95 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.813 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -53.32 -55.39 25.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.891 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.766 ' HG ' HD12 ' B' ' 99' ' ' LEU . 14.0 tp -60.96 -41.25 95.99 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.96 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.509 HD12 HG12 ' B' ' 92' ' ' VAL . 27.1 mt -69.36 -42.79 74.77 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.392 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -66.0 -18.51 65.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.903 0.859 . . . . 0.0 109.368 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.02 -51.01 6.62 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.759 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.766 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -77.48 -48.15 17.83 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.451 -1.704 . . . . 0.0 115.019 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.59 HD22 ' HB ' ' B' ' 50' ' ' ILE . 19.0 mt -48.92 -56.29 16.07 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.664 ' HA ' ' HG2' ' B' ' 104' ' ' LYS . 19.6 Cg_endo -57.05 -15.33 17.21 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.27 1.98 . . . . 0.0 114.034 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.2 mttm -87.59 -20.51 26.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.502 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 26.7 m-85 -125.8 -19.54 4.86 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.664 ' HG2' ' HA ' ' B' ' 101' ' ' PRO . 16.4 ptpt -53.86 149.45 8.81 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.4 118.21 36.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.071 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.46 ' HD3' ' H ' ' B' ' 107' ' ' ALA . 0.0 OUTLIER -156.52 -46.4 0.07 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.311 178.761 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 107' ' ' ALA . . . . . 0.46 ' H ' ' HD3' ' B' ' 106' ' ' LYS . . . -154.62 34.51 0.41 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-N 114.528 -1.214 . . . . 0.0 108.49 -178.388 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.735 ' CE2' ' HB3' ' A' ' 395' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 7.7 p -77.61 128.4 38.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 91.31 -63.71 2.69 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.314 -179.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.735 ' HB3' ' CE2' ' A' ' 392' ' ' TYR . 4.7 tp10 -97.29 139.2 33.61 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.486 ' C ' ' H ' ' A' ' 398' ' ' GLU . 25.0 t70 -126.82 32.84 5.05 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.53 16.88 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.934 -1.104 . . . . 0.0 113.76 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.486 ' H ' ' C ' ' A' ' 396' ' ' ASP . 2.5 pt-20 89.2 -37.73 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.334 1.454 . . . . 0.0 113.616 176.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.594 ' HB2' ' HZ1' ' B' ' 62' ' ' LYS . 7.2 tt0 -150.05 122.61 8.54 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.898 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.6 OUTLIER -170.63 83.97 0.1 Allowed 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.929 -177.625 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.458 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.7 p-10 -138.52 -46.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 402' ' ' ASP . . . . . 0.491 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 2.6 p30 -72.8 7.25 2.06 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.498 0.666 . . . . 0.0 110.208 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 1.009 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -54.1 126.51 23.01 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.794 179.467 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -111.15 122.15 47.14 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.98 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 8.0 pt-20 -125.61 131.17 52.74 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -178.94 28.34 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.027 0.441 . . . . 0.0 110.662 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.85 -25.79 61.23 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.511 ' OE2' ' HE2' ' B' ' 104' ' ' LYS . 3.5 pt-20 -179.67 -172.09 0.2 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.852 178.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -151.09 89.9 1.56 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.519 ' OD2' ' HB3' ' B' ' 106' ' ' LYS . 17.7 t70 . . . . . 0 C--O 1.243 0.747 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.16 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.602 ' HA ' ' HG2' ' B' ' 6' ' ' GLU . 13.2 tpt . . . . . 0 N--CA 1.484 1.229 0 CA-C-O 120.624 0.249 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.17 -68.24 0.17 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.154 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 24.2 m -155.35 -46.65 0.08 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 3.2 p -160.85 -62.05 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.942 0.401 . . . . 0.0 110.099 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 2.5 m -84.05 81.01 8.98 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.602 ' HG2' ' HA ' ' B' ' 1' ' ' MET . 0.5 OUTLIER -84.61 -169.42 2.62 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.627 -177.207 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.415 ' O ' ' HA ' ' B' ' 27' ' ' MET . 3.0 mp0 -59.22 101.86 0.11 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.686 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 79.7 t -82.8 105.34 12.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.4 mt -84.44 -29.54 26.01 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.728 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.492 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.32 125.56 29.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.9 mt -112.68 116.07 51.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.773 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -107.05 147.77 11.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.575 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -107.84 175.38 5.5 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.051 -178.54 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.657 ' HE2' ' HA ' ' B' ' 81' ' ' ASN . 29.3 mtpt 18.23 76.17 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 O-C-N 125.147 1.53 . . . . 0.0 113.552 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.575 HG23 ' O ' ' B' ' 13' ' ' LYS . 40.1 t -124.2 120.14 58.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.811 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.579 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 26.3 mtp180 -90.85 125.9 35.88 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.223 0.535 . . . . 0.0 111.032 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.429 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 2.8 tp-100 -117.21 112.18 20.47 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.891 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.1 OUTLIER 66.12 43.18 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.601 0.563 . . . . 0.0 110.639 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 70.59 19.28 6.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.472 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.499 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 46.1 tt0 -125.93 119.22 27.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.452 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.433 ' CG ' ' HG2' ' B' ' 16' ' ' ARG . 2.2 m-20 -68.68 153.74 43.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.037 0.446 . . . . 0.0 111.689 -179.257 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 178.43 -158.88 23.83 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.038 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 134.59 49.99 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.218 0.532 . . . . 0.0 110.62 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.938 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.33 139.73 32.85 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.509 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -135.94 108.52 7.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.584 0.23 . . . . 0.0 110.417 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.929 HD11 HG13 ' B' ' 92' ' ' VAL . 9.3 mt -86.84 125.65 34.12 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.628 ' HB2' ' HD2' ' B' ' 30' ' ' ARG . 5.4 mtm -106.69 173.67 6.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.921 0.391 . . . . 0.0 111.57 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.42 -52.9 7.39 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -118.22 8.03 12.23 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.628 ' HD2' ' HB2' ' B' ' 27' ' ' MET . 0.0 OUTLIER -158.7 151.0 21.55 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.95 -1.1 . . . . 0.0 112.666 -178.249 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.961 HD13 HD11 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -97.69 122.77 49.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.576 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -124.78 156.64 37.4 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.993 0.425 . . . . 0.0 110.828 -179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.938 ' HB2' HD12 ' B' ' 24' ' ' LEU . 39.1 t90 -147.12 132.72 18.78 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.453 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -114.7 136.25 22.44 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.105 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.871 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 24.0 Cg_exo -61.57 159.06 33.75 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.19 1.927 . . . . 0.0 111.062 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -62.47 134.54 56.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.308 0.575 . . . . 0.0 111.682 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 62.62 12.35 40.24 Favored Glycine 0 CA--C 1.521 0.414 0 CA-C-N 115.552 -0.749 . . . . 0.0 113.993 179.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.871 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 40.4 mttp -113.43 140.77 47.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.384 0.592 . . . . 0.0 110.807 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -85.18 -14.12 47.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.141 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.439 ' HG2' ' H ' ' B' ' 40' ' ' ARG . 2.2 ptp180 -106.13 129.9 54.12 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.188 0.518 . . . . 0.0 112.322 -178.01 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.442 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 45.3 m-85 -78.19 121.14 23.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.26 178.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 7.5 p -94.62 -7.72 40.1 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.642 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -119.95 118.65 57.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.306 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.2 t -148.01 101.61 3.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.823 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -124.13 137.22 54.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.465 ' O ' HG12 ' B' ' 50' ' ' ILE . 33.0 mtp -88.94 142.32 27.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.638 ' HB3' ' HA ' ' B' ' 100' ' ' LEU . 20.4 m-85 -57.5 -23.0 47.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.696 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.26 -27.21 65.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.938 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.564 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.15 -5.84 43.14 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.873 0.368 . . . . 0.0 111.147 -179.025 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.766 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -89.36 129.86 39.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.608 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 1.1 tttp -90.06 -41.39 11.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.201 0.524 . . . . 0.0 110.641 -178.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.608 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 4.7 p -163.79 -177.6 5.23 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.76 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' GLN . . . . . 0.664 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 5.5 pt20 -140.58 145.49 36.8 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.371 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.063 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 53.6 mttp -108.39 136.7 47.59 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.186 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.491 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -118.78 124.63 73.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 176.056 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.41 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -85.04 118.35 70.7 Favored Pre-proline 0 C--O 1.25 1.102 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -178.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 68.8 Cg_endo -68.88 173.24 10.46 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 125.117 3.878 . . . . 0.0 113.996 -178.249 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 160.5 5.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.482 -1.235 . . . . 0.0 109.885 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.13 7.91 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.491 ' HG3' ' OD2' ' A' ' 402' ' ' ASP . 5.6 mttp -86.82 153.79 21.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.57 -14.14 62.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.436 0.636 . . . . 0.0 109.944 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.594 ' HZ1' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -137.69 141.79 41.08 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.557 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.508 HG21 ' HA ' ' B' ' 86' ' ' VAL . 3.8 mp -84.27 133.81 28.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -134.57 162.89 31.03 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 118.559 -1.256 . . . . 0.0 114.359 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.488 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.82 152.96 46.94 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 113.791 -1.55 . . . . 0.0 107.909 177.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.063 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.72 145.58 30.03 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.629 0.649 . . . . 0.0 110.48 177.94 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.961 HD11 HD13 ' B' ' 31' ' ' ILE . 96.1 mt -96.94 111.7 23.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.052 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.556 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.1 t -95.54 112.86 28.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.618 HD22 HD13 ' B' ' 50' ' ' ILE . 1.7 mt -97.43 158.46 15.46 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.564 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -80.21 -1.77 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.29 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.403 ' HB3' ' OD1' ' B' ' 73' ' ' ASP . . . -73.46 -16.68 61.3 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.67 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 103.02 8.66 41.4 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.899 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 73' ' ' ASP . . . . . 0.507 ' OD1' HD12 ' B' ' 69' ' ' LEU . 8.0 p-10 -126.42 172.24 10.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.199 0.523 . . . . 0.0 111.841 -179.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.556 HG22 ' HA ' ' B' ' 68' ' ' VAL . 30.4 p -137.58 143.57 41.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.574 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.554 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 16.7 m -116.82 109.38 17.02 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.504 0.322 . . . . 0.0 110.511 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.898 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.9 m-20 -82.31 154.46 25.3 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.38 0.61 . . . . 0.0 112.628 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.642 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.7 m-85 -141.5 104.01 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.834 -1.075 . . . . 0.0 108.834 178.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.579 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.2 t-160 -86.9 105.28 16.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.493 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.62 ' CE1' HG11 ' B' ' 12' ' ' VAL . 48.9 m-85 -76.71 101.61 5.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.3 p -95.62 7.27 46.75 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.949 0.404 . . . . 0.0 111.69 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.657 ' HA ' ' HE2' ' B' ' 14' ' ' LYS . 63.8 t30 -86.09 90.81 8.23 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -33.66 18.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 41.1 m -58.89 -59.96 4.62 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.486 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.78 13.15 6.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.513 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -46.52 -45.01 18.27 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.508 ' HA ' HG21 ' B' ' 63' ' ' ILE . 2.9 t -59.57 -54.72 30.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.006 0.432 . . . . 0.0 110.563 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.486 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.7 mptt -65.56 -36.76 84.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.192 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.686 ' O ' HG23 ' B' ' 92' ' ' VAL . 14.0 mt-10 -65.04 -43.56 91.97 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.498 ' HD3' HG23 ' B' ' 63' ' ' ILE . 23.9 ttp180 -56.6 -49.26 75.45 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.51 -42.75 97.06 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.368 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -44.1 78.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.822 0.283 . . . . 0.0 110.97 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.929 HG13 HD11 ' B' ' 26' ' ' LEU . 38.9 t -60.26 -43.63 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.664 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 2.9 ttpt -60.19 -53.42 57.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.138 178.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 94' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 2.1 m-20 -56.3 -51.25 68.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.879 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.722 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.7 tp -64.89 -37.39 87.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.719 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.413 HD12 HG12 ' B' ' 92' ' ' VAL . 27.9 mt -72.31 -47.59 48.72 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 121.308 -0.157 . . . . 0.0 111.06 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 97' ' ' GLN . . . . . 0.515 ' N ' HE22 ' B' ' 53' ' ' GLN . 13.5 pt20 -60.01 -21.66 61.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.193 0.997 . . . . 0.0 109.143 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.421 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 1.4 mm-40 -85.94 -47.83 9.26 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.135 -1.393 . . . . 0.0 111.363 178.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.722 HD12 ' HG ' ' B' ' 95' ' ' LEU . 13.6 mt -81.84 -38.69 25.09 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.256 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.766 HD22 ' HB ' ' B' ' 50' ' ' ILE . 30.2 mt -53.14 -62.66 3.18 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.602 ' HA ' ' HE3' ' B' ' 104' ' ' LYS . 40.3 Cg_endo -66.51 -7.7 18.64 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.815 1.677 . . . . 0.0 113.36 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 12.4 mtmm -81.26 -31.87 33.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.784 0.326 . . . . 0.0 110.309 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -104.87 -35.4 7.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.196 0.522 . . . . 0.0 110.614 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.602 ' HE3' ' HA ' ' B' ' 101' ' ' PRO . 0.8 OUTLIER -77.34 110.72 12.31 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.002 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -124.81 60.71 1.18 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.166 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.519 ' HB3' ' OD2' ' A' ' 410' ' ' ASP . 2.4 ttpm? -95.73 -61.31 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.546 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -144.21 15.57 1.68 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.434 -0.506 . . . . 0.0 112.199 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.423 ' HB3' ' NZ ' ' B' ' 104' ' ' LYS . 55.6 t30 . . . . . 0 C--O 1.249 1.065 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.587 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.557 ' CG ' ' HB2' ' A' ' 396' ' ' ASP . 0.3 OUTLIER . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.523 0.202 . . . . 0.0 110.526 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.15 -107.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -73.84 -18.05 79.47 Favored Glycine 0 C--O 1.227 -0.311 0 N-CA-C 108.34 -1.904 . . . . 0.0 108.34 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.463 ' HG3' ' H ' ' A' ' 397' ' ' ASP . 7.2 tp10 -172.15 157.75 4.36 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 112.609 -1.795 . . . . 0.0 106.192 178.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.557 ' HB2' ' CG ' ' A' ' 392' ' ' TYR . 17.1 t70 -105.81 30.44 5.8 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.579 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.588 ' HA ' ' HA ' ' B' ' 18' ' ' LYS . 14.6 t70 -53.78 -34.93 60.62 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.427 ' HB3' ' CD ' ' B' ' 62' ' ' LYS . 0.1 OUTLIER 166.49 -30.04 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 O-C-N 124.332 1.02 . . . . 0.0 110.396 177.666 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.89 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 65.1 tt0 173.01 95.08 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -178.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.612 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 2.4 m-20 -140.87 92.05 2.47 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.451 -175.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.521 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.4 OUTLIER -139.51 -48.39 0.47 Allowed 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -73.13 17.5 0.13 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.636 0.731 . . . . 0.0 111.229 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.921 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -55.64 128.74 36.09 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.878 179.124 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -101.9 133.33 46.85 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.4 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.45 ' HB2' ' HG2' ' B' ' 54' ' ' LYS . 10.0 tt0 -121.8 139.98 52.93 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.214 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -162.23 42.44 0.13 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 407' ' ' ASP . . . . . 0.595 ' HB3' ' HB2' ' B' ' 52' ' ' CYS . 1.3 t70 -109.61 -7.28 15.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.882 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.451 ' HB3' ' H ' ' A' ' 409' ' ' ASP . 0.4 OUTLIER 52.98 -159.29 0.13 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.954 -1.021 . . . . 0.0 113.032 179.457 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.451 ' H ' ' HB3' ' A' ' 408' ' ' GLU . 1.3 m-20 -111.94 8.83 20.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.046 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.411 ' C ' ' HD2' ' B' ' 104' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.905 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.377 -179.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.547 ' H2 ' ' CD ' ' B' ' 6' ' ' GLU . 1.9 mpt? . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.71 37.17 19.19 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.501 0.667 . . . . 0.0 109.762 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 4.5 m -77.83 -63.28 1.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.609 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.58 ' HB2' ' HG2' ' B' ' 29' ' ' GLU . 20.0 m -148.41 -57.71 0.23 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 121.199 -0.2 . . . . 0.0 110.824 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 2.7 p -129.45 -28.52 2.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.547 ' CD ' ' H2 ' ' B' ' 1' ' ' MET . 5.2 tp10 66.45 21.45 10.83 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.859 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.454 ' O ' ' HA ' ' B' ' 27' ' ' MET . 15.2 pt-20 -81.56 115.65 20.96 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.041 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 70.2 t -84.13 112.6 21.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.682 ' HB2' HD21 ' B' ' 95' ' ' LEU . 23.0 mt -87.04 -28.9 22.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.158 -178.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.447 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -140.1 138.24 35.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.245 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 86.1 mt -121.75 126.47 74.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.699 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.0 t -118.25 148.24 21.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.638 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -110.62 -178.68 3.55 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.349 -179.358 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.494 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 47.8 mtpt 18.06 69.39 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 O-C-N 125.42 1.7 . . . . 0.0 113.559 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.638 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.5 t -119.17 123.35 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.558 179.115 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.639 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 13.8 mtp-105 -98.14 121.36 39.97 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.086 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 23.8 tm0? -105.63 103.29 12.77 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 50.9 mttt 52.81 62.87 2.47 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.761 0.663 . . . . 0.0 110.937 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 396' ' ' ASP . 1.9 mptm? 68.43 24.61 7.13 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 113.088 178.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.639 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 20.5 mt-30 -129.84 119.31 23.13 Favored 'General case' 0 C--O 1.222 -0.375 0 O-C-N 122.23 -0.293 . . . . 0.0 111.275 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -75.08 145.04 42.64 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.149 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.33 -167.64 39.34 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.653 -0.784 . . . . 0.0 113.613 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.86 137.68 54.69 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.125 0.57 . . . . 0.0 109.803 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.928 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -100.54 140.82 34.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.232 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -135.62 124.67 24.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.844 HD11 HG13 ' B' ' 92' ' ' VAL . 16.0 mt -108.03 122.85 47.7 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.668 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.454 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 1.4 mpt? -103.35 160.88 14.31 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.484 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.49 -22.24 54.36 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.58 ' HG2' ' HB2' ' B' ' 4' ' ' SER . 1.1 mp0 -105.96 -23.23 12.71 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' B' ' 45' ' ' HIS . 0.0 OUTLIER -160.38 172.72 16.78 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.692 -0.803 . . . . 0.0 112.879 -176.582 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.983 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -112.67 122.89 67.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.742 178.3 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.473 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -122.57 150.45 42.59 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.928 ' HB2' HD12 ' B' ' 24' ' ' LEU . 36.8 t90 -146.87 137.02 23.49 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -123.86 142.32 39.15 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.5 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.1 159.08 48.45 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.379 2.053 . . . . 0.0 111.167 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.12 137.37 57.98 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.379 -179.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.8 29.81 75.84 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.333 -0.849 . . . . 0.0 113.192 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.444 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 19.1 mmtm -113.7 151.82 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.057 0.429 . . . . 0.0 110.936 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -99.82 -12.76 19.62 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.866 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -123.49 146.41 48.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.059 0.457 . . . . 0.0 111.571 -178.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -87.06 121.64 29.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.002 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.4 p -85.84 -23.65 27.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.34 0.59 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.6 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 16.4 mm -103.42 118.74 50.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.018 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 33.4 t -147.83 101.45 3.31 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.502 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 68.9 m-70 -124.67 132.03 53.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.221 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.536 ' O ' HG12 ' B' ' 50' ' ' ILE . 81.1 mmm -81.85 143.32 31.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.343 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.468 ' CE1' HD13 ' B' ' 99' ' ' LEU . 22.3 m-30 -56.97 -24.08 50.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 110.608 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.22 -27.55 64.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.992 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.575 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -93.35 -7.16 45.57 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.021 0.438 . . . . 0.0 110.683 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.625 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.0 mm -87.88 130.64 37.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.863 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 1.5 ttpt -87.52 -37.58 16.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.298 0.571 . . . . 0.0 109.817 -179.215 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.863 ' SG ' ' HE2' ' B' ' 51' ' ' LYS . 21.8 p -171.89 -178.13 2.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.78 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -143.33 140.77 30.7 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.262 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.062 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.8 mttp -107.04 156.17 19.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.527 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.6 OUTLIER -131.56 131.57 62.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 176.227 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.11 120.77 66.66 Favored Pre-proline 0 C--O 1.252 1.209 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.59 172.75 12.85 Favored 'Trans proline' 0 C--O 1.233 0.246 1 C-N-CA 125.319 4.013 . . . . 0.0 114.57 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -64.04 160.48 17.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.158 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.72 -29.03 8.08 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -178.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.89 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.6 mttp -86.96 160.36 18.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.143 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.9 -9.86 59.63 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.401 0.62 . . . . 0.0 109.658 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.638 ' HD3' ' HB3' ' A' ' 399' ' ' GLU . 3.7 ptmt -134.5 129.82 35.73 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.194 -179.24 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.48 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -83.53 131.53 33.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 177.036 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.588 ' CG ' ' HE2' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -137.95 163.88 30.42 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -175.366 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.526 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.5 tp -139.63 153.46 47.33 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.046 -1.888 . . . . 0.0 106.842 176.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.062 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.3 138.02 24.81 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 119.254 0.934 . . . . 0.0 111.451 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.983 HD11 HD13 ' B' ' 31' ' ' ILE . 95.8 mt -94.01 100.54 12.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.923 179.126 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.703 ' HA ' HG22 ' B' ' 74' ' ' THR . 5.2 t -84.14 104.34 12.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.057 -0.719 . . . . 0.0 109.057 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.613 HD22 HD13 ' B' ' 50' ' ' ILE . 2.9 mt -91.36 158.67 16.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.913 0.387 . . . . 0.0 111.408 -178.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.575 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -81.25 -0.6 41.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.163 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.77 -9.29 58.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.582 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.08 9.7 56.85 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.0 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -126.4 151.58 47.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.927 0.394 . . . . 0.0 110.861 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.703 HG22 ' HA ' ' B' ' 68' ' ' VAL . 21.8 p -121.4 130.34 53.54 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.561 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.5 m -99.02 98.65 9.67 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.439 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.6 m-20 -83.9 143.39 29.9 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.102 0.477 . . . . 0.0 111.28 -178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.454 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 65.2 m-85 -128.85 112.8 14.51 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.131 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.565 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.2 t-160 -86.55 104.75 16.29 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.639 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.697 ' CE2' HG11 ' B' ' 12' ' ' VAL . 52.2 m-85 -76.45 94.32 3.65 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 5.8 p -99.28 12.82 35.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.494 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 40.3 t30 -85.09 91.94 8.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -45.93 -32.38 2.68 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.836 0.854 . . . . 0.0 112.928 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.26 -60.64 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.508 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -128.63 11.88 6.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 -176.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.659 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -42.94 -50.31 5.83 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -52.32 60.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.868 0.366 . . . . 0.0 110.91 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.508 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.45 -35.68 80.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.9 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.682 ' O ' HG23 ' B' ' 92' ' ' VAL . 14.3 mt-10 -64.75 -44.31 90.52 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.502 ' HD2' HD12 ' B' ' 55' ' ' ILE . 20.6 ttp180 -56.18 -48.64 75.97 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.6 -43.83 96.99 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.588 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.4 -42.23 83.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 117.713 0.233 . . . . 0.0 111.178 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.844 HG13 HD11 ' B' ' 26' ' ' LEU . 38.2 t -62.23 -43.85 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.434 ' HB2' HD11 ' B' ' 65' ' ' LEU . 0.6 OUTLIER -57.9 -53.98 52.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.992 178.118 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.7 -54.54 45.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.868 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.863 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.7 tp -62.08 -35.7 79.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.355 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.45 HD12 HG12 ' B' ' 92' ' ' VAL . 28.3 mt -74.41 -47.37 34.24 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 97' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' B' ' 97' ' ' GLN . 0.0 OUTLIER -60.29 -21.59 62.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.278 1.037 . . . . 0.0 109.136 178.682 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -87.03 -45.49 10.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.171 -1.377 . . . . 0.0 111.482 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.863 HD12 ' HG ' ' B' ' 95' ' ' LEU . 10.6 mt -85.0 -43.81 13.64 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -176.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.625 HD22 ' HB ' ' B' ' 50' ' ' ILE . 22.7 mt -51.21 -60.51 5.56 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -176.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.494 ' O ' ' HA ' ' B' ' 107' ' ' ALA . 26.1 Cg_endo -59.72 -5.76 3.83 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.496 2.131 . . . . 0.0 114.177 -177.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -85.65 -20.89 28.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.852 0.358 . . . . 0.0 110.486 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -126.52 -15.41 5.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.455 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.469 ' HB3' ' HA ' ' B' ' 101' ' ' PRO . 26.8 ttmt -66.01 124.15 21.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.113 -178.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 64.82 -74.05 0.05 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.264 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' B' ' 106' ' ' LYS . 1.2 ttpm? -163.33 12.78 0.06 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 -178.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 107' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' B' ' 101' ' ' PRO . . . 59.44 78.27 0.27 Allowed 'General case' 0 C--O 1.234 0.237 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -177.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 . . . . . 0 C--O 1.244 0.78 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.173 -178.107 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 33.6 p90 . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 17.4 t -62.63 105.28 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 111.98 -91.6 0.61 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.079 -1.208 . . . . 0.0 110.079 -178.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.54 ' OE2' ' HA ' ' A' ' 395' ' ' GLU . 3.2 tp10 -94.22 135.94 35.05 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 398' ' ' GLU . 1.6 t70 -122.15 30.7 6.47 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -179.112 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.98 15.67 0.19 Allowed 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.361 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.504 ' H ' ' C ' ' A' ' 396' ' ' ASP . 15.2 tt0 94.78 -84.45 0.0 OUTLIER 'General case' 0 C--N 1.343 0.313 0 C-N-CA 125.293 1.437 . . . . 0.0 114.331 176.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.952 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.1 tt0 -126.0 96.83 4.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.738 0.304 . . . . 0.0 111.548 -176.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.516 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 6.9 p-10 -136.53 91.67 2.68 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.511 0.672 . . . . 0.0 111.725 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.495 ' C ' ' H ' ' A' ' 403' ' ' PHE . 26.3 p-10 -139.16 -47.4 0.48 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -71.92 9.33 0.95 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.515 0.674 . . . . 0.0 110.592 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.798 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -52.03 118.3 3.37 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 404' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' B' ' 54' ' ' LYS . 1.0 OUTLIER -79.43 130.42 35.4 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.509 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.652 ' HG2' ' HE3' ' B' ' 54' ' ' LYS . 1.9 mm-40 -90.15 176.67 6.68 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.494 0.664 . . . . 0.0 112.044 -178.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -155.16 146.18 22.61 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.225 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -113.22 14.89 19.46 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.595 ' HG2' ' HB2' ' B' ' 97' ' ' GLN . 0.0 OUTLIER -71.98 51.35 0.22 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.822 0.344 . . . . 0.0 111.921 -179.739 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.59 -64.3 0.91 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.511 ' HB3' ' HD2' ' B' ' 104' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.143 0 O-C-N 124.792 1.307 . . . . 0.0 109.042 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 54.1 ttm . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.42 -28.69 1.27 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.211 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 56.9 p -100.68 -165.07 1.17 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.333 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -87.92 33.1 0.72 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.374 0.606 . . . . 0.0 110.153 179.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' SER . . . . . 0.42 ' O ' ' HB2' ' B' ' 6' ' ' GLU . 66.1 m -155.13 -152.64 0.41 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.706 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' B' ' 5' ' ' SER . 24.3 mt-10 78.7 24.15 0.59 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.573 0.701 . . . . 0.0 109.725 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -93.72 101.19 13.32 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.658 179.514 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.523 HG11 HG12 ' B' ' 11' ' ' ILE . 74.3 t -92.7 112.75 26.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 CA-C-O 120.905 0.383 . . . . 0.0 110.493 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.6 mt -88.86 -32.17 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.433 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.536 ' HB3' ' HB2' ' B' ' 26' ' ' LEU . 6.1 tp -129.87 123.52 31.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.59 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.523 HG12 HG11 ' B' ' 8' ' ' VAL . 56.5 mt -107.97 120.9 60.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.878 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.2 t -112.13 149.99 14.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.617 ' O ' HG23 ' B' ' 15' ' ' VAL . 2.0 mtmp? -115.9 -179.78 3.75 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.705 -178.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 18.15 63.51 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 O-C-N 125.214 1.571 . . . . 0.0 113.937 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.3 t -113.73 127.09 71.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 84.0 mtt180 -100.6 126.63 47.1 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.409 0.623 . . . . 0.0 111.619 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.497 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 5.6 tp-100 -105.84 103.39 12.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 0.6 OUTLIER 63.89 47.22 3.58 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.658 0.599 . . . . 0.0 110.16 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.4 OUTLIER 74.08 9.22 4.65 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.138 179.364 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.673 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.4 tp-100 -104.89 118.44 36.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.45 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 0.4 OUTLIER -72.11 147.5 46.63 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.328 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.578 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . 178.29 -160.68 26.96 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.904 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.4 136.21 50.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.965 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.32 139.11 33.76 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.298 -179.016 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 25' ' ' TYR . . . . . 0.404 ' CE1' HG23 ' B' ' 11' ' ' ILE . 75.7 m-85 -132.63 109.59 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.389 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 1.049 HD11 HG13 ' B' ' 92' ' ' VAL . 9.0 mt -87.46 125.22 34.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.836 0.35 . . . . 0.0 110.892 -179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.538 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 41.6 mtt -103.73 164.02 11.95 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.98 -39.18 71.45 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.944 ' HA ' ' HZ ' ' B' ' 103' ' ' PHE . 25.9 mm-40 -113.02 1.49 15.38 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.455 ' NH1' ' HB2' ' B' ' 29' ' ' GLU . 0.0 OUTLIER -161.76 154.61 20.43 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 119.522 -0.871 . . . . 0.0 112.76 -178.064 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.815 HD13 HD11 ' B' ' 67' ' ' LEU . 1.2 tt -102.81 118.13 49.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -118.56 152.2 36.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.398 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.965 ' HB2' HD12 ' B' ' 24' ' ' LEU . 38.1 t90 -147.09 134.71 21.01 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.451 ' HB2' ' CD2' ' B' ' 41' ' ' PHE . . . -120.96 129.61 25.22 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.78 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.641 ' HG2' ' HD3' ' B' ' 38' ' ' LYS . 47.4 Cg_endo -73.55 143.71 34.77 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.498 2.132 . . . . 0.0 111.7 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.557 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 63.2 mt-10 -61.64 131.2 49.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 0.0 110.856 -179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.65 -10.62 60.96 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.834 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.641 ' HD3' ' HG2' ' B' ' 35' ' ' PRO . 5.8 mptt -113.65 152.51 30.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -100.9 -18.5 16.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.68 127.91 53.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.008 0.432 . . . . 0.0 111.816 -178.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.451 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 44.6 m-85 -63.95 121.09 13.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.56 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.38 -34.23 23.62 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.984 0.421 . . . . 0.0 110.843 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.829 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 24.2 mm -93.43 122.69 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.909 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 35.8 t -147.95 101.2 3.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.403 ' CD2' HG23 ' B' ' 43' ' ' ILE . 79.9 m-70 -127.43 140.51 52.12 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.491 ' O ' HG12 ' B' ' 50' ' ' ILE . 27.8 mtp -91.82 144.88 25.04 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.746 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.5 m-30 -60.29 -19.8 56.49 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.838 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.92 -21.53 63.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.379 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.533 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -101.51 -11.28 19.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.001 0.429 . . . . 0.0 110.6 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.751 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.5 mm -88.68 125.89 41.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.642 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 9.3 tmtt? -86.18 -38.04 18.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.03 0.443 . . . . 0.0 109.919 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.642 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 28.3 p -169.55 -177.81 2.86 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.402 -0.817 . . . . 0.0 108.917 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.11 141.94 46.12 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.751 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.064 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 26.9 mttp -102.62 146.7 27.79 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.507 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.569 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.77 126.82 69.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.174 -1.046 . . . . 0.0 108.174 177.247 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.449 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.56 118.5 69.09 Favored Pre-proline 0 C--O 1.249 1.062 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.76 173.03 10.65 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 125.079 3.853 . . . . 0.0 114.624 -177.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -61.69 160.51 11.5 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.395 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.02 8.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 109.606 -1.397 . . . . 0.0 109.606 -177.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.952 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 12.8 mttp -87.75 152.66 21.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.06 -11.11 60.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.212 0.529 . . . . 0.0 110.544 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.487 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.95 138.0 35.21 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.661 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.533 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -83.3 140.55 16.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 177.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.449 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 86.8 mt-30 -139.98 162.86 34.19 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 118.529 -1.269 . . . . 0.0 114.081 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -142.38 153.81 44.09 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.58 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.064 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.37 144.83 30.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 118.978 0.808 . . . . 0.0 110.328 178.025 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.815 HD11 HD13 ' B' ' 31' ' ' ILE . 96.7 mt -94.06 104.51 16.54 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.229 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.616 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 45.0 t -88.92 120.36 37.5 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.487 HD12 ' HB3' ' B' ' 73' ' ' ASP . 9.4 mt -101.93 151.78 21.71 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.112 0.482 . . . . 0.0 111.791 -177.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.533 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.2 -7.55 54.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.611 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.3 -4.79 46.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.425 -1.262 . . . . 0.0 110.875 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.73 21.53 46.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' ASP . . . . . 0.487 ' HB3' HD12 ' B' ' 69' ' ' LEU . 20.1 t70 -126.02 160.92 28.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.446 -0.377 . . . . 0.0 110.222 -179.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.594 HG22 ' HA ' ' B' ' 68' ' ' VAL . 12.0 p -142.68 131.48 22.79 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.571 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 19.9 m -110.77 107.07 16.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.266 0.226 . . . . 0.0 110.434 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.29 151.18 26.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.517 . . . . 0.0 112.318 -178.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.829 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 35.9 m-85 -134.93 115.53 13.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.606 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.63 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.0 t-160 -87.35 100.91 13.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.887 -179.007 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.703 ' HZ ' HG21 ' B' ' 92' ' ' VAL . 22.9 m-85 -77.12 102.13 6.43 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.76 22.19 15.67 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.862 0.689 . . . . 0.0 112.862 -178.201 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.437 HD22 ' HA ' ' B' ' 81' ' ' ASN . 1.2 t-20 -89.45 97.06 10.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 110.292 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.09 -30.29 2.68 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.42 -59.53 2.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -178.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.482 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.0 p -127.38 11.05 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -175.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.643 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -45.63 -45.67 14.06 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.475 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.3 t -59.88 -52.67 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.803 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -67.52 -34.52 77.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.038 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.666 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.1 mt-10 -65.06 -45.61 84.59 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.569 ' HD2' ' HB ' ' B' ' 55' ' ' ILE . 24.7 ttp180 -54.06 -47.79 71.27 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 122.21 1.005 . . . . 0.0 108.398 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.27 -44.98 93.59 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.514 -1.675 . . . . 0.0 112.6 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.67 90.91 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.74 0.245 . . . . 0.0 111.154 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 1.049 HG13 HD11 ' B' ' 26' ' ' LEU . 42.9 t -60.87 -44.89 98.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -57.93 -54.65 44.51 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.063 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 94' ' ' ASP . . . . . 0.473 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 1.6 m-20 -55.37 -52.16 64.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.494 -1.23 . . . . 0.0 112.525 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.823 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -65.23 -28.42 69.35 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.822 -178.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 35.5 mt -78.47 -45.74 21.38 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.377 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 97' ' ' GLN . . . . . 0.595 ' HB2' ' HG2' ' A' ' 408' ' ' GLU . 2.5 pt20 -63.14 -18.24 63.22 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.249 1.023 . . . . 0.0 109.156 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -88.47 -47.96 7.96 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.927 -1.488 . . . . 0.0 111.057 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.823 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -83.62 -41.31 17.97 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.751 HD22 ' HB ' ' B' ' 50' ' ' ILE . 35.7 mt -51.96 -50.85 76.01 Favored Pre-proline 0 CA--C 1.54 0.596 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.441 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 21.6 Cg_exo -66.08 -23.09 53.82 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.182 1.921 . . . . 0.0 115.146 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 11.0 pttp -72.49 1.81 7.41 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.941 -0.475 . . . . 0.0 112.096 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.944 ' HZ ' ' HA ' ' B' ' 29' ' ' GLU . 30.2 m-85 -106.27 2.51 26.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.384 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.511 ' HD2' ' HB3' ' A' ' 410' ' ' ASP . 33.3 mttt -131.15 -178.39 4.81 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.768 -178.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.8 77.12 0.89 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.091 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -116.25 -66.64 1.06 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.145 178.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -123.62 18.23 9.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.854 0.359 . . . . 0.0 111.692 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.244 0.779 0 CA-C-O 118.74 -0.648 . . . . 0.0 109.75 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.449 ' HB2' ' H ' ' A' ' 393' ' ' VAL . 1.6 p90 . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 120.623 0.249 . . . . 0.0 110.701 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 393' ' ' VAL . . . . . 0.449 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 7.6 p -66.3 137.41 24.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.731 0.301 . . . . 0.0 110.286 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 83.7 -65.59 4.08 Favored Glycine 0 N--CA 1.451 -0.317 0 N-CA-C 111.129 -0.789 . . . . 0.0 111.129 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.505 ' OE2' ' HG2' ' B' ' 18' ' ' LYS . 7.4 tp10 -121.8 130.7 53.6 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -136.72 29.93 2.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.468 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.64 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 36.7 t70 -54.04 -41.2 67.81 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.571 -178.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.485 ' HB3' ' H ' ' A' ' 399' ' ' GLU . 0.2 OUTLIER 172.55 -102.02 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 178.35 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.539 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 3.8 pt-20 -105.04 104.34 14.05 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.831 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -132.77 83.91 2.1 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.758 -178.612 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.493 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.7 p-10 -138.23 -47.37 0.52 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -73.81 12.28 0.7 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.513 0.673 . . . . 0.0 110.442 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.826 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -53.78 122.13 9.31 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.884 179.44 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -86.12 135.89 33.43 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.716 ' HB2' ' HG2' ' B' ' 54' ' ' LYS . 33.4 tt0 -144.31 162.49 36.28 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 121.973 0.892 . . . . 0.0 113.373 -177.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 406' ' ' ASN . . . . . 0.431 ' N ' ' HG2' ' A' ' 405' ' ' GLU . 35.6 t30 -131.48 147.43 52.55 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 105.301 -2.111 . . . . 0.0 105.301 176.62 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.06 -59.59 5.12 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.941 -0.704 . . . . 0.0 111.347 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 32.56 48.5 0.12 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 124.529 1.143 . . . . 0.0 111.709 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -45.79 -48.26 15.58 Favored 'General case' 0 CA--C 1.514 -0.406 0 O-C-N 123.899 0.749 . . . . 0.0 110.2 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.614 ' HB3' ' HE3' ' B' ' 104' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.169 0 O-C-N 124.847 1.342 . . . . 0.0 112.183 178.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -166.24 -67.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.606 -179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 13.0 m -158.01 88.93 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.366 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 14.7 m 72.65 -56.17 0.66 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.656 0.782 . . . . 0.0 111.619 179.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 4.7 m -76.43 128.28 34.5 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 71.05 22.15 4.62 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.877 0.846 . . . . 0.0 109.939 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.468 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.5 OUTLIER -76.73 114.59 15.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.127 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -81.97 115.94 25.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.0 mt -96.0 -30.39 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.092 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.463 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -132.92 122.73 24.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 80.3 mt -109.13 118.36 56.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.74 HG11 ' HE2' ' B' ' 79' ' ' PHE . 2.6 t -112.22 147.79 15.77 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.648 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.0 OUTLIER -109.22 -177.65 3.35 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 18.97 74.29 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 O-C-N 125.388 1.68 . . . . 0.0 112.883 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.648 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.8 t -124.44 122.59 64.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.314 179.18 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.627 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 7.3 mtp180 -96.25 130.98 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.353 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.613 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 0.7 OUTLIER -121.42 103.38 8.9 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.612 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.505 ' HG2' ' OE2' ' A' ' 395' ' ' GLU . 5.7 mtpp 59.15 64.89 1.29 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.179 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.64 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 1.0 OUTLIER 68.93 22.89 6.9 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 176.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.655 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.9 pt20 -145.69 132.64 20.21 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.995 0.816 . . . . 0.0 110.858 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.41 ' CA ' ' HG2' ' B' ' 16' ' ' ARG . 1.6 t70 -86.23 153.76 21.78 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.07 -156.34 17.09 Favored Glycine 0 CA--C 1.522 0.516 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.756 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.31 135.11 54.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.882 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -100.69 140.85 34.38 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.481 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -135.96 109.83 8.17 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.817 0.342 . . . . 0.0 110.236 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.956 HD11 HG13 ' B' ' 92' ' ' VAL . 10.6 mt -89.0 120.84 30.78 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.53 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.468 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 36.5 mtt -102.24 161.56 13.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.043 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -28.82 57.86 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.927 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.92 -16.9 13.43 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ptp85 -158.91 162.01 36.84 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.796 -0.761 . . . . 0.0 112.822 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.898 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.07 114.81 41.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.741 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -113.56 150.36 33.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.976 0.417 . . . . 0.0 110.836 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.882 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.9 t90 -147.56 141.71 26.11 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.007 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -128.6 136.94 29.9 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.257 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.692 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 20.0 Cg_exo -64.75 158.22 51.83 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.566 2.177 . . . . 0.0 112.104 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -56.17 121.61 9.85 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.413 0.625 . . . . 0.0 112.099 -178.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.05 29.77 68.53 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.266 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.692 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.64 136.47 52.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.034 0.417 . . . . 0.0 110.358 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.4 -16.51 42.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.372 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -109.64 138.21 46.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.689 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -82.97 120.39 25.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.3 p -96.88 -6.49 35.71 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.089 0.471 . . . . 0.0 110.957 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.614 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 11.1 mm -119.88 117.32 53.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.079 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.6 t -147.9 101.33 3.29 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.438 ' CD2' HG23 ' B' ' 43' ' ' ILE . 69.9 m-70 -122.13 128.99 51.94 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.463 ' O ' HG12 ' B' ' 50' ' ' ILE . 65.4 mmm -80.04 141.11 36.18 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.574 ' HB3' ' HA ' ' B' ' 100' ' ' LEU . 23.1 m-85 -56.15 -24.77 43.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.941 0.4 . . . . 0.0 110.95 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.65 -29.18 65.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.121 -179.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.602 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -89.8 -4.82 57.44 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.188 0.518 . . . . 0.0 110.592 -179.041 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.569 HD13 HD22 ' B' ' 69' ' ' LEU . 4.4 mm -88.34 128.86 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.459 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -85.39 -43.73 13.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.558 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.613 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 6.7 p -161.6 -177.82 6.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.733 -178.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -142.22 143.59 32.96 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.963 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.041 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 27.6 mttp -112.92 153.44 27.98 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.299 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.599 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -132.2 125.48 54.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.691 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -89.41 115.53 64.0 Favored Pre-proline 0 C--O 1.249 1.051 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.28 172.57 7.42 Favored 'Trans proline' 0 CA--C 1.518 -0.297 0 C-N-CA 125.155 3.903 . . . . 0.0 114.68 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.68 158.87 17.35 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.441 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.58 -29.16 8.04 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 109.841 -1.303 . . . . 0.0 109.841 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.539 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 4.2 mttm -82.36 156.26 24.32 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 176.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.19 -18.5 61.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.64 0.733 . . . . 0.0 109.271 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.401 ' HB2' ' CD2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -134.41 119.63 18.81 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.104 -179.518 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.514 HG12 HG22 ' B' ' 86' ' ' VAL . 3.1 mp -72.74 134.57 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.474 HE21 ' HB2' ' B' ' 64' ' ' GLN . 11.0 mt-30 -137.5 163.32 31.43 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -176.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.484 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -138.11 153.15 49.28 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 175.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.041 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -144.96 138.49 26.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 119.505 1.048 . . . . 0.0 111.478 179.043 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.898 HD11 HD13 ' B' ' 31' ' ' ILE . 94.7 mt -94.21 105.96 17.94 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.853 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.613 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -91.54 111.78 24.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.569 HD22 HD13 ' B' ' 50' ' ' ILE . 2.3 mt -100.34 158.65 15.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -176.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.602 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -77.49 -6.98 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.208 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.87 -7.79 52.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.727 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.4 15.04 57.81 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.814 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -126.22 155.46 41.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.996 0.427 . . . . 0.0 110.954 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.558 HG22 ' HA ' ' B' ' 68' ' ' VAL . 24.3 p -129.96 131.46 45.96 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.009 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.544 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 4.3 m -105.82 105.08 14.95 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.485 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.831 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.6 m-20 -82.09 137.65 34.98 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.548 0.689 . . . . 0.0 111.811 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.612 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.3 m-85 -125.57 102.5 7.4 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 114.653 -1.158 . . . . 0.0 108.724 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.627 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.4 t-160 -86.84 117.13 25.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.206 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.74 ' HE2' HG11 ' B' ' 12' ' ' VAL . 70.7 m-85 -83.28 94.84 8.0 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.46 1.05 54.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' B' ' 85' ' ' ALA . 0.2 OUTLIER -78.17 91.08 4.3 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.038 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.57 -35.4 3.94 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 19.3 m -60.7 -60.71 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 17.9 p -128.23 15.73 6.69 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.474 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.68 -46.3 7.36 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.651 HG12 ' HD2' ' B' ' 87' ' ' LYS . 24.3 t -58.32 -53.09 51.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 0.0 111.574 -179.475 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.651 ' HD2' HG12 ' B' ' 86' ' ' VAL . 0.0 OUTLIER -75.7 -25.15 56.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.623 -178.921 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.607 ' O ' HG23 ' B' ' 92' ' ' VAL . 16.0 mt-10 -67.26 -40.32 86.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 176.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.532 ' NE ' HD12 ' B' ' 55' ' ' ILE . 18.5 ttp180 -59.44 -45.89 90.29 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 90' ' ' ASP . . . . . 0.639 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 83.6 m-20 -58.69 -48.34 81.42 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.78 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.09 -42.03 94.45 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.956 HG13 HD11 ' B' ' 26' ' ' LEU . 60.9 t -62.02 -43.39 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.639 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 11.1 ttpp -58.92 -51.93 67.93 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.942 177.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -58.75 -54.31 48.5 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.889 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.74 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.5 tp -59.61 -38.85 82.37 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.705 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.76 -42.67 70.15 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.7 -24.3 67.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 122.383 1.087 . . . . 0.0 109.008 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -85.9 -47.94 9.19 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.934 -1.485 . . . . 0.0 111.425 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.74 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -80.78 -43.02 20.79 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 115.189 1.552 . . . . 0.0 115.189 -176.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.642 ' HB2' ' HD3' ' B' ' 101' ' ' PRO . 24.7 mt -51.14 -59.89 6.76 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.642 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 29.6 Cg_exo -62.73 -16.07 50.75 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.012 1.808 . . . . 0.0 113.251 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.5 mtmm -78.69 -15.56 58.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 110.281 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -121.19 12.85 11.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.476 0.655 . . . . 0.0 109.548 179.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.614 ' HE3' ' HB3' ' A' ' 410' ' ' ASP . 17.1 mtpp -121.74 170.12 10.06 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.452 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 105' ' ' ARG . . . . . 0.756 ' HA ' ' CZ ' ' B' ' 105' ' ' ARG . 0.0 OUTLIER 179.59 -41.82 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -179.731 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 410' ' ' ASP . 2.5 tptp 175.91 81.16 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.475 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -101.41 14.99 30.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.555 0.693 . . . . 0.0 110.102 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 12.0 p30 . . . . . 0 C--O 1.244 0.814 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.255 -179.628 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.45 ' HB2' ' H ' ' A' ' 393' ' ' VAL . 5.6 p90 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 393' ' ' VAL . . . . . 0.45 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 24.6 t -70.44 121.26 19.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 89.1 -79.39 1.61 Allowed Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -99.66 149.98 22.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.931 0.395 . . . . 0.0 110.038 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.435 ' C ' ' H ' ' A' ' 398' ' ' GLU . 15.1 t70 -136.63 15.91 3.13 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.039 -179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.697 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 0.2 OUTLIER -76.55 16.43 0.49 Allowed 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.98 -179.367 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.697 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 2.7 mt-10 101.65 -72.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.868 1.667 . . . . 0.0 111.943 178.089 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.534 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER -141.97 116.55 9.68 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 120.788 0.327 . . . . 0.0 110.572 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.445 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 0.6 OUTLIER -141.14 83.27 1.87 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.267 -179.345 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.556 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.2 p-10 -138.25 -46.67 0.52 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 402' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' B' ' 60' ' ' LYS . 2.3 p30 -72.97 11.58 0.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 122.047 0.927 . . . . 0.0 110.017 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.907 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -60.51 115.77 3.83 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.514 179.062 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -107.71 130.99 54.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.741 -0.208 . . . . 0.0 111.554 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.429 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 1.6 pt-20 -108.76 -108.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 406' ' ' ASN . . . . . 0.496 HD22 ' HG3' ' A' ' 408' ' ' GLU . 0.7 OUTLIER -152.2 -176.67 5.77 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.741 179.522 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -70.92 -34.75 71.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -176.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.496 ' HG3' HD22 ' A' ' 406' ' ' ASN . 0.1 OUTLIER -73.33 163.91 27.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.634 0.73 . . . . 0.0 112.819 -177.773 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.849 ' HA ' ' HE3' ' B' ' 51' ' ' LYS . 11.7 t0 -149.74 54.52 0.94 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.624 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.406 ' OD2' ' HG3' ' B' ' 106' ' ' LYS . 4.0 t70 . . . . . 0 C--O 1.248 0.979 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.998 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 48.6 ttp . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.28 -31.75 15.28 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.86 -165.43 1.3 Allowed 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 114.22 -1.355 . . . . 0.0 108.563 178.273 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -55.83 18.85 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 5' ' ' SER . . . . . 0.942 ' HB3' ' HB2' ' B' ' 29' ' ' GLU . 0.2 OUTLIER -179.58 54.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.351 178.339 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -112.39 -3.24 14.54 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.782 0.801 . . . . 0.0 110.438 -178.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.54 ' O ' ' HA ' ' B' ' 27' ' ' MET . 1.2 pm0 -75.55 102.02 5.11 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.829 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 62.9 t -81.73 120.95 34.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.112 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 27.9 mt -97.48 -31.83 12.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.93 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.2 tp -129.27 120.0 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.866 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.407 HG23 ' CE2' ' B' ' 25' ' ' TYR . 70.0 mt -103.9 120.93 54.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.939 -0.764 . . . . 0.0 108.939 177.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.833 HG21 HD23 ' B' ' 24' ' ' LEU . 3.3 t -111.27 149.31 14.06 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.383 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.576 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -113.86 179.32 3.99 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.543 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.499 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.48 72.04 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 O-C-N 125.328 1.642 . . . . 0.0 113.22 -178.155 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.576 HG23 ' O ' ' B' ' 13' ' ' LYS . 47.6 t -117.32 124.4 72.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.907 -1.042 . . . . 0.0 108.969 178.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.618 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.2 mtp180 -97.02 129.19 44.51 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.383 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.29 103.64 8.34 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.881 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.98 45.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.243 0 O-C-N 123.767 0.667 . . . . 0.0 110.65 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.423 ' HA ' ' CZ ' ' B' ' 16' ' ' ARG . 0.0 OUTLIER 67.13 23.4 9.58 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.792 179.59 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 2.9 tp-100 -123.67 119.43 29.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.605 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.78 153.32 27.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.189 0.519 . . . . 0.0 112.349 -177.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.02 -154.49 13.02 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.602 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.45 132.1 48.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.917 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.49 141.69 30.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 25' ' ' TYR . . . . . 0.407 ' CE2' HG23 ' B' ' 11' ' ' ILE . 37.4 m-85 -135.23 120.33 18.79 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.963 HD11 HG13 ' B' ' 92' ' ' VAL . 14.5 mt -99.94 116.24 31.53 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.03 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.54 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.8 mpt? -92.92 163.48 13.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.657 178.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.78 -39.9 62.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.942 ' HB2' ' HB3' ' B' ' 5' ' ' SER . 58.5 mp0 -110.48 -5.04 15.23 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.182 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.435 ' HG2' ' HB2' ' B' ' 5' ' ' SER . 14.4 ptt-85 -161.09 158.76 28.23 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.394 -0.922 . . . . 0.0 112.587 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.938 HD13 HD11 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.83 128.98 59.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.126 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.455 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -129.91 153.6 48.17 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.9 0.381 . . . . 0.0 110.509 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.917 ' HB2' HD12 ' B' ' 24' ' ' LEU . 36.5 t90 -147.01 141.8 26.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.451 ' HB2' ' HA ' ' B' ' 41' ' ' PHE . . . -128.25 143.91 49.81 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.866 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 34' ' ' ALA . 17.3 Cg_exo -65.48 153.01 80.14 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.699 2.266 . . . . 0.0 111.354 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -65.32 116.11 6.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.963 0.411 . . . . 0.0 110.21 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.25 8.75 54.75 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.301 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.905 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -105.04 144.8 31.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.689 0.757 . . . . 0.0 111.57 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.02 -22.31 27.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.172 -1.376 . . . . 0.0 111.523 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -122.13 150.29 42.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 0.0 111.611 -178.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.451 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 16.0 m-85 -79.9 143.4 34.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.17 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.1 -25.31 13.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.141 0.496 . . . . 0.0 110.476 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.838 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 16.3 mm -104.01 124.95 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.385 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.6 t -148.14 101.73 3.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.502 ' CD2' HG23 ' B' ' 43' ' ' ILE . 60.2 m-70 -130.25 138.43 50.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.528 ' O ' HG12 ' B' ' 50' ' ' ILE . 30.6 mtp -90.83 145.28 24.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.276 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.635 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.0 m-85 -57.84 -24.1 55.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.667 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.63 -26.2 64.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.876 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.54 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.96 -7.48 36.41 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.993 0.425 . . . . 0.0 110.735 -179.436 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.693 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -86.9 127.44 40.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.849 ' HE3' ' HA ' ' A' ' 409' ' ' ASP . 0.2 OUTLIER -81.38 -40.38 23.57 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.178 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.537 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 31.8 p -173.28 -177.84 1.6 Allowed 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.459 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' GLN . . . . . 0.571 HE22 HD11 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -137.71 139.34 40.11 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.909 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.058 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -102.76 151.4 22.44 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.573 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -128.03 128.98 69.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 175.897 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.414 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -90.05 114.08 59.56 Favored Pre-proline 0 C--O 1.249 1.068 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 64.4 Cg_endo -68.67 172.94 10.71 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 125.103 3.869 . . . . 0.0 114.492 -177.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -58.98 157.86 9.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.035 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.32 -29.03 8.21 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.534 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 4.1 mttm -85.28 160.09 19.92 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.1 -13.35 59.35 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.695 ' HB3' ' CD2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -131.72 127.75 37.49 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.568 -179.329 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.598 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -78.11 125.0 37.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 176.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -133.44 163.58 29.05 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -175.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.612 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -140.56 153.32 46.08 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 113.659 -1.609 . . . . 0.0 107.52 176.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.058 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.62 145.48 30.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 119.273 0.942 . . . . 0.0 111.141 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.938 HD11 HD13 ' B' ' 31' ' ' ILE . 73.1 mt -96.27 106.22 18.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.026 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.581 ' HA ' HG22 ' B' ' 74' ' ' THR . 10.6 t -93.25 121.87 44.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.491 HD22 HD13 ' B' ' 50' ' ' ILE . 4.3 mt -108.36 154.35 21.96 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -177.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.54 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.34 -5.73 46.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.747 0.784 . . . . 0.0 108.94 178.274 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.43 -4.11 43.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.559 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.57 21.04 55.19 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.371 -0.692 . . . . 0.0 111.371 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.05 157.3 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.514 -0.343 . . . . 0.0 110.533 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.581 HG22 ' HA ' ' B' ' 68' ' ' VAL . 19.8 p -139.86 131.03 26.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.548 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.3 102.68 11.78 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.464 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -82.36 139.14 34.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.338 0.589 . . . . 0.0 111.637 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.838 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 53.5 m-85 -129.53 110.92 12.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.012 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.695 ' CD2' ' HB3' ' B' ' 62' ' ' LYS . 5.3 t-160 -87.51 121.24 29.7 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.01 179.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.727 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 42.4 m-85 -85.03 93.6 8.63 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.5 13.68 25.22 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.499 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.0 OUTLIER -86.08 94.27 9.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.316 0.579 . . . . 0.0 110.513 179.47 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.74 -31.05 1.81 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.05 -59.52 2.7 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -178.191 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.509 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.3 p -127.32 14.16 7.16 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -176.221 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -45.36 -49.66 12.83 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 t -59.14 -51.4 73.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 110.876 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.509 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.6 mttt -66.38 -34.53 78.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.054 0.454 . . . . 0.0 109.979 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.613 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -65.84 -44.81 84.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.598 ' HD3' HG23 ' B' ' 63' ' ' ILE . 23.1 ttp180 -55.61 -45.33 77.51 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 90' ' ' ASP . . . . . 0.733 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -63.56 -45.79 88.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.733 -1.576 . . . . 0.0 112.519 179.676 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.22 81.85 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.924 0.329 . . . . 0.0 111.421 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.963 HG13 HD11 ' B' ' 26' ' ' LEU . 45.3 t -62.79 -39.38 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.733 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.6 OUTLIER -62.17 -56.89 14.18 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.563 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 94' ' ' ASP . . . . . 0.4 ' O ' ' HG2' ' B' ' 98' ' ' GLN . 1.6 m-20 -54.09 -53.89 46.93 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.801 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.732 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -61.64 -39.42 91.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.202 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.7 mt -69.47 -45.17 69.63 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 117.946 0.339 . . . . 0.0 110.366 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -64.24 -18.63 64.73 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.851 0.834 . . . . 0.0 109.475 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' B' ' 94' ' ' ASP . 27.9 mm-40 -85.88 -51.36 6.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.901 178.264 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.732 HD12 ' HG ' ' B' ' 95' ' ' LEU . 15.2 mt -76.0 -46.76 27.85 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.415 -1.721 . . . . 0.0 115.361 -176.473 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.693 HD22 ' HB ' ' B' ' 50' ' ' ILE . 31.5 mt -50.39 -60.15 5.85 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -61.74 -14.48 36.47 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.008 1.805 . . . . 0.0 113.146 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 20.3 mtmm -86.97 -14.51 41.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.17 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -117.3 -18.25 9.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.606 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 15.2 mtpt -60.93 108.55 0.88 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.806 0.336 . . . . 0.0 110.232 179.238 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 105' ' ' ARG . . . . . 0.5 ' HA ' ' HE ' ' B' ' 105' ' ' ARG . 9.9 mmp_? -107.24 54.63 0.67 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.452 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.447 ' HB2' ' HE2' ' B' ' 106' ' ' LYS . 12.7 ptmm? -148.34 166.93 26.57 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.37 -0.377 . . . . 0.0 109.988 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -154.19 23.2 0.49 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.428 0.632 . . . . 0.0 109.486 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.0 t30 . . . . . 0 C--O 1.245 0.829 0 CA-C-N 114.591 -1.186 . . . . 0.0 108.773 -179.241 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.487 ' O ' ' HB ' ' A' ' 393' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.624 0.249 . . . . 0.0 111.036 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 393' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 93.2 t 78.09 123.38 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.058 0.543 . . . . 0.0 110.441 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 84.82 -57.88 5.0 Favored Glycine 0 CA--C 1.509 -0.317 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -119.59 113.81 21.27 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 106.519 -1.66 . . . . 0.0 106.519 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -134.39 31.8 3.43 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.722 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 27.8 t70 -40.54 -34.99 0.4 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 174.28 -86.28 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.848 0.356 . . . . 0.0 111.454 178.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.989 ' HG2' ' HE2' ' B' ' 62' ' ' LYS . 3.9 pt-20 -120.47 112.87 19.5 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.906 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -143.55 84.53 1.8 Allowed 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.132 -0.627 . . . . 0.0 112.537 -177.244 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.519 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.7 p-10 -139.15 -45.67 0.47 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -72.37 11.06 0.65 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 110.271 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.923 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.02 112.55 1.55 Allowed 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.414 179.24 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -99.69 135.93 40.38 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.411 -177.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.998 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 17.9 pt-20 -143.07 161.67 37.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.585 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 406' ' ' ASN . . . . . 0.536 ' HA ' ' OE1' ' A' ' 408' ' ' GLU . 50.8 t30 -169.95 35.42 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -112.94 -6.43 13.77 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.404 -1.271 . . . . 0.0 109.7 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.578 ' HA ' ' HB3' ' B' ' 52' ' ' CYS . 5.5 pm0 -60.38 144.78 50.04 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 -178.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.623 ' OD1' ' HG3' ' B' ' 51' ' ' LYS . 18.1 p-10 -103.99 -166.09 1.22 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 105.935 -1.876 . . . . 0.0 105.935 175.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 . . . . . 0 C--N 1.314 -0.958 0 CA-C-N 118.681 0.673 . . . . 0.0 110.173 179.646 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 49.7 ttp . . . . . 0 N--CA 1.476 0.875 0 CA-C-O 120.505 0.193 . . . . 0.0 110.828 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.74 -77.85 0.05 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.962 0.411 . . . . 0.0 110.803 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 19.9 m -155.52 105.29 2.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.818 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 7.8 m 62.12 29.98 17.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.253 0.549 . . . . 0.0 110.55 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.0 95.11 2.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.336 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 70.5 41.6 0.95 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 122.013 0.911 . . . . 0.0 108.543 -178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.551 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.2 OUTLIER -96.77 102.99 14.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.094 -179.632 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 88.5 t -81.76 114.01 22.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.533 HD12 HD11 ' B' ' 99' ' ' LEU . 22.7 mt -95.29 -29.01 14.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.264 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.454 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -137.4 137.3 38.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.055 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 75.5 mt -122.85 115.96 47.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.716 HG21 HD23 ' B' ' 24' ' ' LEU . 3.0 t -104.93 149.25 8.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.09 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.535 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.08 173.21 6.42 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.57 -179.177 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.59 ' HE3' ' HA ' ' B' ' 81' ' ' ASN . 22.1 mtmt 18.23 82.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 125.341 1.651 . . . . 0.0 113.471 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.535 HG23 ' O ' ' B' ' 13' ' ' LYS . 31.6 t -129.02 123.6 59.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.186 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.634 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 6.8 mtp-105 -98.61 141.27 31.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.213 0.53 . . . . 0.0 112.22 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -132.5 103.43 6.17 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 177.096 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.646 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 59.4 mttp 65.09 56.54 1.02 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.026 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.722 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 2.8 mptp? 68.83 23.93 6.69 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.155 177.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.554 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 63.5 tt0 -135.83 119.72 17.41 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.65 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -81.94 153.15 26.42 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.821 0.344 . . . . 0.0 111.72 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.672 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -177.38 -158.36 20.33 Favored Glycine 0 CA--C 1.521 0.433 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.186 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.42 136.83 54.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.126 0.488 . . . . 0.0 110.648 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.946 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.3 139.7 35.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.128 -178.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.45 125.72 29.63 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.899 HD11 HG13 ' B' ' 92' ' ' VAL . 16.9 mt -107.94 117.34 33.87 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.476 -0.489 . . . . 0.0 111.128 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.551 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.2 mpt? -97.49 159.68 14.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.14 -27.83 55.64 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.101 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.976 ' HA ' ' HE2' ' B' ' 103' ' ' PHE . 0.9 OUTLIER -103.07 -25.12 13.53 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.13 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.492 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -157.97 169.86 23.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.915 -175.989 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.916 HD13 HD11 ' B' ' 67' ' ' LEU . 1.5 tt -110.79 122.14 64.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.661 178.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.459 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -123.17 149.82 44.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.011 0.434 . . . . 0.0 110.599 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.946 ' HB2' HD12 ' B' ' 24' ' ' LEU . 39.7 t90 -146.68 134.07 20.75 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.466 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -122.92 131.46 24.36 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.334 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.672 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 9.3 Cg_exo -70.3 160.0 51.08 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.536 2.157 . . . . 0.0 111.353 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 145.26 55.78 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.918 0.39 . . . . 0.0 109.972 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.35 24.87 74.93 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.555 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' B' ' 38' ' ' LYS . 25.3 mmtm -114.19 153.36 29.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.587 0.232 . . . . 0.0 110.579 179.101 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -106.39 5.02 29.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.556 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -151.73 160.18 43.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.24 -179.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -86.1 125.71 33.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.083 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 3.0 p -90.64 -22.48 21.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.29 0.567 . . . . 0.0 110.328 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.638 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 17.8 mm -107.46 118.62 55.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.111 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -147.93 101.58 3.31 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.477 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 59.1 m-70 -127.74 134.87 49.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.281 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.494 ' O ' HG12 ' B' ' 50' ' ' ILE . 84.0 mmm -84.79 143.07 29.35 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.708 ' HB2' ' HD2' ' B' ' 103' ' ' PHE . 22.7 m-30 -57.28 -22.69 43.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.83 0.348 . . . . 0.0 111.294 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.19 -26.87 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.893 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.617 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.6 OUTLIER -94.28 -4.21 49.19 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 110.6 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.619 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.7 mm -90.35 128.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.623 ' HG3' ' OD1' ' A' ' 409' ' ' ASP . 51.4 tttp -85.43 -40.68 16.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.396 0.617 . . . . 0.0 109.452 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.592 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.8 p -168.59 -177.62 3.18 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.291 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -143.06 139.57 30.56 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.313 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.998 ' HG2' ' HB3' ' A' ' 405' ' ' GLU . 53.2 mttp -106.99 161.44 14.72 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.668 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -133.07 130.15 57.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 175.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -91.27 118.0 68.2 Favored Pre-proline 0 C--O 1.25 1.086 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.66 173.08 11.4 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 124.966 3.778 . . . . 0.0 114.011 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -59.95 160.84 7.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.161 178.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.23 -28.76 8.09 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -177.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.553 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 14.5 mttp -89.52 158.29 17.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 176.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.96 -5.71 42.95 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.241 0.543 . . . . 0.0 110.485 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.989 ' HE2' ' HG2' ' A' ' 399' ' ' GLU . 0.7 OUTLIER -142.78 146.69 34.49 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.049 -179.558 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.697 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -90.61 131.47 37.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.53 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 24.5 mt-30 -131.9 163.16 28.93 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.526 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -140.82 153.45 45.8 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.417 -1.719 . . . . 0.0 106.642 175.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 0.942 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.47 142.39 28.05 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 119.149 0.886 . . . . 0.0 111.875 179.135 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.916 HD11 HD13 ' B' ' 31' ' ' ILE . 89.6 mt -94.33 104.49 16.47 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.928 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.664 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.1 t -90.14 114.39 27.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.548 HD22 HD13 ' B' ' 50' ' ' ILE . 4.0 mt -100.75 155.64 17.8 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -177.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.617 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -77.69 -3.46 41.23 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.279 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.94 -7.33 56.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.259 179.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.04 17.59 50.49 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.866 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -126.25 160.29 30.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.698 0.285 . . . . 0.0 110.8 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.664 HG22 ' HA ' ' B' ' 68' ' ' VAL . 21.2 p -137.71 131.73 31.79 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.552 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.4 m -106.48 109.57 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.41 0.148 . . . . 0.0 111.302 -179.555 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.906 HD21 ' HB3' ' A' ' 400' ' ' ASP . 5.6 m-20 -82.29 147.29 28.97 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.742 0.782 . . . . 0.0 112.19 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.638 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 43.1 m-85 -134.51 103.5 5.71 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.743 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.634 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.6 t-160 -86.46 107.78 18.22 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.513 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.672 ' CE2' HG11 ' B' ' 12' ' ' VAL . 54.2 m-85 -76.26 94.37 3.55 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.158 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.04 5.16 47.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.891 -178.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.59 ' HA ' ' HE3' ' B' ' 14' ' ' LYS . 46.4 t30 -85.98 91.13 8.29 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.448 ' CD ' ' H ' ' B' ' 82' ' ' GLU . 0.7 OUTLIER -51.66 -29.09 16.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.543 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 2.1 m -60.13 -60.21 4.18 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.512 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.9 p -128.34 12.76 6.54 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.127 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.55 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.7 -50.04 7.68 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.417 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -58.34 -52.44 59.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.848 0.356 . . . . 0.0 110.869 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.512 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.4 mttt -66.4 -37.33 84.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.052 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.686 ' O ' HG23 ' B' ' 92' ' ' VAL . 13.8 mt-10 -63.95 -43.55 95.49 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.221 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.697 ' HD3' HG23 ' B' ' 63' ' ' ILE . 28.4 ttp180 -56.63 -49.67 74.29 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 90' ' ' ASP . . . . . 0.541 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -59.85 -43.3 94.7 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.635 -1.62 . . . . 0.0 112.225 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -43.47 74.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.675 0.216 . . . . 0.0 111.27 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.899 HG13 HD11 ' B' ' 26' ' ' LEU . 40.2 t -61.02 -42.72 94.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.668 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.3 tmmt? -59.34 -58.66 7.65 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.722 178.181 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.31 -53.91 44.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.158 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.549 ' HG ' ' CD1' ' B' ' 99' ' ' LEU . 10.7 tp -62.12 -37.13 83.95 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.182 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.456 HD12 HG12 ' B' ' 92' ' ' VAL . 26.0 mt -73.34 -41.01 63.97 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.7 -19.96 59.93 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.197 0.998 . . . . 0.0 108.971 178.259 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -93.86 -51.9 4.68 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.813 -1.54 . . . . 0.0 111.043 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.657 ' HB3' ' CE1' ' B' ' 47' ' ' TYR . 42.4 mt -75.75 -28.41 58.48 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.494 -1.685 . . . . 0.0 115.432 -176.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.619 HD22 ' HB ' ' B' ' 50' ' ' ILE . 36.4 mt -72.5 -58.18 3.08 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 18.6 Cg_endo -57.59 -19.18 35.98 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.542 2.162 . . . . 0.0 114.178 -177.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 17.9 pttm -80.5 -11.98 59.6 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.172 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.976 ' HE2' ' HA ' ' B' ' 29' ' ' GLU . 17.5 m-30 -124.09 -0.16 8.4 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.772 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 81.7 mttt -67.94 100.57 0.98 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.529 0.68 . . . . 0.0 112.182 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 53.0 ttp85 -107.44 11.52 28.83 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.694 178.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp 73.03 0.36 3.66 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.049 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -178.42 -176.44 0.5 Allowed 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.454 -1.248 . . . . 0.0 107.941 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.84 -0.6 . . . . 0.0 109.683 179.649 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.59 ' HD2' ' HB2' ' A' ' 396' ' ' ASP . 63.0 t80 . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 120.741 0.305 . . . . 0.0 111.049 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 22.3 t -134.13 -84.11 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -89.29 -27.17 23.72 Favored Glycine 0 CA--C 1.505 -0.57 0 N-CA-C 107.345 -2.302 . . . . 0.0 107.345 176.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 392' ' ' TYR . 0.0 OUTLIER -146.55 -167.53 2.78 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 177.755 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.59 ' HB2' ' HD2' ' A' ' 392' ' ' TYR . 41.4 t0 -136.56 30.37 2.89 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 119.122 -1.031 . . . . 0.0 111.756 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.576 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 0.5 OUTLIER -62.91 -26.69 68.92 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 119.255 -0.978 . . . . 0.0 108.382 177.825 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.75 ' HB3' ' HE3' ' B' ' 62' ' ' LYS . 3.1 tt0 167.48 -78.46 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.551 177.229 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.879 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 57.7 tt0 -135.27 103.11 5.39 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -178.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.607 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.2 OUTLIER -135.94 91.27 2.67 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.443 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.09 -45.22 0.47 Allowed 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -72.05 8.22 1.35 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.269 0.557 . . . . 0.0 110.774 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.994 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -52.99 120.05 5.39 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.75 179.426 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -99.96 142.59 31.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.352 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 405' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -127.2 150.72 49.4 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.165 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -158.54 23.22 0.23 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.066 0.46 . . . . 0.0 110.818 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 407' ' ' ASP . . . . . 0.622 ' OD1' ' HB3' ' B' ' 52' ' ' CYS . 1.2 t70 -93.25 -24.63 18.1 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.298 -178.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.495 ' O ' ' HB2' ' A' ' 409' ' ' ASP . 3.9 mm-40 52.16 -114.67 0.84 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -178.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.495 ' HB2' ' O ' ' A' ' 408' ' ' GLU . 0.8 OUTLIER 167.98 -57.01 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.429 0 O-C-N 123.782 0.676 . . . . 0.0 109.959 177.508 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.903 -1.046 . . . . 0.0 109.782 179.205 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.4 tpt . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.47 -74.04 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.42 -48.1 3.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.352 0.596 . . . . 0.0 109.458 178.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 28.3 m -159.27 100.5 1.52 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' SER . . . . . 0.493 ' HB3' ' HB2' ' B' ' 29' ' ' GLU . 0.0 OUTLIER -143.56 34.39 1.29 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.724 0.297 . . . . 0.0 111.212 -178.76 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 mp0 -129.88 18.34 5.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.763 0.792 . . . . 0.0 109.829 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.527 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -119.54 117.09 27.46 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.209 -178.966 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -82.53 117.44 28.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.009 0.433 . . . . 0.0 110.755 -179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.3 mt -95.67 -31.66 13.14 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.301 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.457 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -131.37 129.3 41.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.923 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.1 mt -113.82 122.68 68.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.859 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.6 t -113.59 150.27 15.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.634 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.7 mtmp? -116.67 178.6 4.28 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.441 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 1.2 mmtm 18.45 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 O-C-N 125.2 1.562 . . . . 0.0 113.422 -178.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.634 HG23 ' O ' ' B' ' 13' ' ' LYS . 24.7 t -124.01 125.11 70.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.139 179.358 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.644 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.8 mpt_? -93.75 132.78 37.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.92 0.39 . . . . 0.0 110.629 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.416 ' HG3' HG13 ' B' ' 43' ' ' ILE . 5.2 tm0? -129.59 113.74 15.19 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.143 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.475 ' HD3' ' HA ' ' B' ' 18' ' ' LYS . 0.5 OUTLIER 66.4 41.03 3.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.952 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.478 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 2.2 mptp? 68.52 29.94 5.4 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.051 179.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.6 tp-100 -131.23 126.64 36.02 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.533 ' CG ' ' HE ' ' B' ' 16' ' ' ARG . 9.3 t0 -73.95 146.57 43.8 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.634 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -179.1 -164.69 32.18 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.656 -0.783 . . . . 0.0 113.84 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.46 136.6 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.182 0.593 . . . . 0.0 109.43 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.932 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -99.13 143.64 29.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.993 -178.452 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -137.57 115.56 11.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.82 0.343 . . . . 0.0 110.173 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.96 HD11 HG13 ' B' ' 92' ' ' VAL . 13.0 mt -94.25 128.41 40.69 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.772 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.527 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 18.8 mtt -106.44 167.98 9.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.775 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.87 65.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -176.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.493 ' HB2' ' HB3' ' B' ' 5' ' ' SER . 61.0 mt-10 -121.67 4.31 10.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.46 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.2 OUTLIER -157.84 156.59 31.71 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 119.29 -0.964 . . . . 0.0 112.68 -177.931 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.973 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -109.08 120.86 61.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 108.592 178.449 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.446 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.04 150.57 40.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.495 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.932 ' HB2' HD12 ' B' ' 24' ' ' LEU . 29.7 t90 -147.12 135.53 21.79 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.44 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -123.74 134.41 25.29 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.137 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 1.051 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -72.48 144.93 41.47 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 122.314 2.01 . . . . 0.0 111.591 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.491 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 32.2 mt-10 -64.45 129.24 39.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.157 0.503 . . . . 0.0 110.648 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.5 1.38 64.17 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.05 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 1.051 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.0 mptt -113.34 151.64 30.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.632 0.253 . . . . 0.0 110.327 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -100.15 8.09 44.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.887 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -138.97 151.67 47.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.131 0.491 . . . . 0.0 112.077 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 65.2 m-85 -86.0 121.36 28.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.585 179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -16.12 29.24 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.232 0.539 . . . . 0.0 110.529 179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.669 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 18.9 mm -113.65 118.91 59.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.752 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.3 t -148.03 101.21 3.27 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.483 ' CD2' HG23 ' B' ' 43' ' ' ILE . 54.5 m-70 -128.12 138.58 52.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.537 ' O ' HG12 ' B' ' 50' ' ' ILE . 61.6 mmm -88.33 143.64 26.89 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.2 m-85 -59.84 -21.71 61.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 110.305 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.15 -15.3 61.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.482 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.574 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.33 -10.48 18.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.29 0.567 . . . . 0.0 109.52 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.691 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.6 mm -90.31 126.29 43.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.445 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 0.1 OUTLIER -86.67 -41.0 14.56 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.286 0.565 . . . . 0.0 110.063 -179.085 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.635 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -160.71 -177.83 6.44 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.574 -179.499 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.48 140.47 26.25 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.798 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.046 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.7 mttp -105.15 156.85 17.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.743 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -132.08 126.85 57.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.414 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -90.52 118.88 69.06 Favored Pre-proline 0 C--O 1.247 0.935 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.54 172.8 11.78 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 124.67 3.58 . . . . 0.0 114.34 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -60.79 160.99 8.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.326 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.52 -29.19 7.72 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -177.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.879 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.4 mttp -89.03 146.69 24.69 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 175.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.73 -4.22 18.82 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.359 0.599 . . . . 0.0 110.392 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.75 ' HE3' ' HB3' ' A' ' 398' ' ' GLU . 16.1 pttm -139.54 125.6 19.87 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.181 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mp -78.21 137.69 21.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -136.4 163.2 31.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.578 HD13 ' HG2' ' B' ' 89' ' ' ARG . 1.1 tp -141.66 153.44 44.72 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.442 177.099 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.046 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.29 143.62 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 178.65 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.973 HD11 HD13 ' B' ' 31' ' ' ILE . 97.1 mt -97.62 106.01 18.25 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.969 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.635 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 18.5 t -90.35 111.82 23.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.483 HD22 HD13 ' B' ' 50' ' ' ILE . 6.6 mt -93.98 156.5 16.58 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.081 0.467 . . . . 0.0 112.203 -177.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.574 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.66 -3.45 44.11 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.247 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.26 -4.59 53.86 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.578 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.36 19.98 53.42 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -126.09 158.23 35.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.564 -0.318 . . . . 0.0 110.406 -179.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.609 HG22 ' HA ' ' B' ' 68' ' ' VAL . 16.6 p -136.0 131.53 35.13 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.564 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.6 m -107.23 108.47 19.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.188 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.607 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.8 m-20 -82.13 154.66 25.42 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.291 0.567 . . . . 0.0 112.001 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.669 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.3 m-85 -140.5 111.39 6.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.979 -1.009 . . . . 0.0 109.511 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.644 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 0.3 OUTLIER -88.56 104.84 17.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.607 -179.139 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.649 ' HZ ' HG21 ' B' ' 92' ' ' VAL . 41.6 m-85 -80.43 108.98 14.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.514 ' HB3' ' CE1' ' B' ' 78' ' ' HIS . 4.4 p -116.7 5.87 13.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -178.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.488 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -77.8 91.62 4.13 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.807 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.55 -38.64 1.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.966 0.906 . . . . 0.0 113.367 -178.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -58.26 -59.66 4.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.537 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.82 9.01 6.35 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -176.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.466 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.52 -48.3 7.38 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -177.63 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.43 -52.61 58.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.824 0.345 . . . . 0.0 110.644 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.537 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.4 mttt -67.01 -32.67 74.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.152 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.656 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.5 mt-10 -65.46 -46.12 81.07 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.633 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 4.1 tmm_? -57.94 -40.78 81.34 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 90' ' ' ASP . . . . . 0.538 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 1.6 m-20 -64.91 -47.36 78.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.016 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.35 -43.57 81.17 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.96 HG13 HD11 ' B' ' 26' ' ' LEU . 41.5 t -61.0 -41.17 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 177.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.743 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.5 tmmt? -61.32 -57.25 13.1 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.414 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -55.8 15.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.143 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.811 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.1 tp -62.04 -31.19 71.57 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.568 -178.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 23.0 mt -78.63 -43.99 24.95 Favored 'General case' 0 C--O 1.218 -0.6 0 O-C-N 122.219 -0.301 . . . . 0.0 110.749 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 97' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' B' ' 93' ' ' LYS . 21.0 mt-30 -65.56 -17.85 64.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.098 0.951 . . . . 0.0 108.87 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -87.61 -49.56 7.09 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.63 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.811 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.4 mt -81.49 -33.49 31.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 115.401 1.63 . . . . 0.0 115.401 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.718 HD23 ' HB3' ' B' ' 47' ' ' TYR . 58.8 mt -66.82 -57.27 11.95 Favored Pre-proline 0 C--N 1.317 -0.814 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.637 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 39.4 Cg_exo -58.73 -20.62 52.13 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.399 2.066 . . . . 0.0 114.211 -178.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.805 ' HB2' ' HB3' ' B' ' 108' ' ' ASN . 7.2 ptmm? -81.77 -19.72 40.7 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.537 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.445 ' HD1' ' HB2' ' B' ' 47' ' ' TYR . 24.0 m-85 -105.01 -35.97 7.47 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.428 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.566 ' HG2' ' HA ' ' B' ' 101' ' ' PRO . 51.3 pttt -77.05 122.38 24.87 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 177.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 105' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' B' ' 104' ' ' LYS . 62.5 mtt180 73.72 -5.8 1.93 Allowed 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -177.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.419 ' H ' ' C ' ' B' ' 104' ' ' LYS . 9.2 tptp 54.58 71.24 0.54 Allowed 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.367 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 107' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' B' ' 108' ' ' ASN . . . -97.26 10.48 39.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.303 0.573 . . . . 0.0 110.408 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.805 ' HB3' ' HB2' ' B' ' 102' ' ' LYS . 7.0 t-20 . . . . . 0 C--O 1.251 1.153 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.422 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.71 ' HA ' ' OD1' ' A' ' 400' ' ' ASP . 7.8 t80 . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 393' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 68.9 t 84.69 -35.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.721 0.808 . . . . 0.0 110.73 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -77.46 -35.42 37.09 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.021 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 1.012 ' HG2' ' HB2' ' B' ' 76' ' ' ASN . 5.5 tp10 -139.49 159.43 42.18 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.631 ' OD1' ' HE3' ' B' ' 18' ' ' LYS . 0.5 OUTLIER -101.52 10.29 40.48 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.877 ' H ' ' HG3' ' A' ' 395' ' ' GLU . 0.5 OUTLIER -64.68 17.39 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -177.719 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.678 ' HG3' ' HD2' ' B' ' 19' ' ' LYS . 81.5 mt-10 91.18 -41.92 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.72 1.208 . . . . 0.0 112.27 178.13 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.842 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.5 mt-10 -151.36 150.36 30.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.726 0.298 . . . . 0.0 111.799 -178.538 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.71 ' OD1' ' HA ' ' A' ' 392' ' ' TYR . 9.6 p-10 177.86 77.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.643 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.49 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.98 -51.19 0.6 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.412 -0.805 . . . . 0.0 112.964 -178.256 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.53 9.85 0.97 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.315 0.579 . . . . 0.0 110.331 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.912 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -51.92 127.3 20.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.183 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -97.34 134.53 40.49 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.85 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.49 ' CD ' ' HZ2' ' B' ' 54' ' ' LYS . 9.6 tt0 -128.48 140.11 51.98 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.337 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -167.36 42.58 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.734 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 407' ' ' ASP . . . . . 0.489 ' HB3' ' HB2' ' B' ' 52' ' ' CYS . 6.8 t70 -112.24 -32.8 6.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.235 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.46 ' HB3' ' H ' ' A' ' 409' ' ' ASP . 0.5 OUTLIER 44.78 -149.24 0.07 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.995 179.11 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.46 ' H ' ' HB3' ' A' ' 408' ' ' GLU . 0.0 OUTLIER 169.93 -36.15 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.049 179.415 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.479 ' HA ' ' CE ' ' B' ' 106' ' ' LYS . 3.3 m-20 . . . . . 0 C--O 1.253 1.282 0 CA-C-O 117.864 -1.065 . . . . 0.0 111.299 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.694 ' HG3' ' HG2' ' B' ' 6' ' ' GLU . 18.3 ptm . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ALA . . . . . 0.605 ' HA ' ' NH2' ' B' ' 30' ' ' ARG . . . -86.05 113.16 21.91 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.919 0.39 . . . . 0.0 111.495 -179.232 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 26.3 m -145.93 -57.24 0.3 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.447 178.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.454 ' H ' ' CD ' ' B' ' 6' ' ' GLU . 3.0 p -152.25 -80.15 0.1 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.995 0.426 . . . . 0.0 110.604 179.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 22.8 m -137.85 82.53 1.92 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.694 ' HG2' ' HG3' ' B' ' 1' ' ' MET . 18.5 mp0 -102.08 -133.35 0.29 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.438 -177.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.411 ' O ' ' HA ' ' B' ' 27' ' ' MET . 5.8 mp0 -45.88 101.73 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 45.5 t -94.63 108.21 20.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.71 -29.56 25.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.617 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.439 HD23 ' HG ' ' B' ' 26' ' ' LEU . 7.2 tp -136.12 132.76 36.5 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 60.3 mt -117.2 120.79 66.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.803 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.9 t -112.75 148.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.406 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.593 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.47 175.95 5.26 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.285 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.566 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.17 78.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 O-C-N 125.422 1.701 . . . . 0.0 113.667 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.593 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.8 t -129.04 125.54 62.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.798 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.629 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 38.6 mtp180 -99.68 138.2 37.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.245 0.545 . . . . 0.0 111.502 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.416 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -124.92 114.27 18.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 176.714 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.631 ' HE3' ' OD1' ' A' ' 396' ' ' ASP . 0.0 OUTLIER 68.64 31.34 4.68 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.79 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.678 ' HD2' ' HG3' ' A' ' 398' ' ' GLU . 0.0 OUTLIER 76.24 13.06 2.63 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 114.343 -1.298 . . . . 0.0 112.148 -179.763 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.629 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 5.7 tp-100 -105.85 118.9 37.79 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -77.27 149.98 35.36 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 -177.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.731 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -178.39 -155.39 14.3 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.817 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.85 137.6 51.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.139 0.495 . . . . 0.0 110.156 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 1.0 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.47 138.97 34.09 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.006 -178.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -134.06 110.14 9.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.68 0.276 . . . . 0.0 110.338 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.92 HD11 HG13 ' B' ' 92' ' ' VAL . 10.8 mt -87.71 129.0 35.3 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.069 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.411 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 21.7 mtt -109.27 169.1 8.91 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.968 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.88 -50.61 14.22 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -115.29 6.53 14.96 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.605 ' NH2' ' HA ' ' B' ' 2' ' ' ALA . 0.7 OUTLIER -158.42 157.6 32.58 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 119.532 -0.867 . . . . 0.0 112.86 -178.083 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.87 HD13 HD11 ' B' ' 67' ' ' LEU . 1.3 tt -106.77 116.47 50.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 178.049 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -117.97 151.75 36.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.988 0.423 . . . . 0.0 111.044 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 1.0 ' HB2' HD12 ' B' ' 24' ' ' LEU . 47.4 t90 -147.14 136.41 22.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.873 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.47 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -125.73 133.22 24.69 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.382 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 1.001 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 5.6 Cg_exo -74.81 148.68 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.596 2.197 . . . . 0.0 111.62 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.572 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 73.5 mt-10 -65.54 130.86 44.8 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.102 0.477 . . . . 0.0 110.829 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.03 2.19 62.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.129 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 1.001 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 4.3 mptt -113.28 148.89 34.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.691 0.281 . . . . 0.0 110.337 179.692 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -98.06 5.86 48.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.603 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -141.34 152.83 44.74 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.158 0.504 . . . . 0.0 111.844 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -82.98 122.87 28.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.902 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -90.87 -18.61 24.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.31 0.576 . . . . 0.0 110.532 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.626 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 18.1 mm -112.49 117.84 56.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.392 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 25.9 t -148.06 101.46 3.29 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.464 ' CD2' HG23 ' B' ' 43' ' ' ILE . 48.8 m-70 -125.11 138.04 54.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.986 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.504 ' O ' HG12 ' B' ' 50' ' ' ILE . 67.5 mmm -87.94 143.54 27.05 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.5 m-85 -58.73 -21.86 56.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.907 0.384 . . . . 0.0 110.516 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.91 -13.1 60.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.679 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.599 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.4 -10.67 16.83 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.321 0.582 . . . . 0.0 109.586 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.618 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.6 mm -89.37 127.21 42.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.592 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.445 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 21.9 tttp -84.8 -44.53 13.19 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 407' ' ' ASP . 1.8 p -161.29 -178.03 6.42 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.052 -0.976 . . . . 0.0 108.731 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -144.49 142.15 30.06 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.259 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.133 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 28.6 mttp -108.61 155.26 20.88 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.704 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.51 127.65 62.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 176.447 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.432 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -90.64 116.91 67.46 Favored Pre-proline 0 C--O 1.249 1.029 0 C-N-CA 120.016 -0.674 . . . . 0.0 109.432 -179.041 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 73.6 Cg_endo -69.36 173.37 10.72 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 125.24 3.96 . . . . 0.0 113.767 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -58.38 160.33 5.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.647 -1.16 . . . . 0.0 110.092 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.2 7.87 Favored Glycine 0 C--N 1.315 -0.605 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.776 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 6.7 mttm -88.66 152.92 21.51 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.4 -9.11 55.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.335 0.588 . . . . 0.0 110.456 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.842 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.65 141.98 37.02 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.689 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.693 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -83.85 130.19 36.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.478 HE21 ' HB2' ' B' ' 64' ' ' GLN . 3.6 mt-30 -132.05 162.78 29.94 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 118.805 -1.158 . . . . 0.0 113.851 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.432 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 2.0 tp -139.91 153.56 47.0 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.851 -1.522 . . . . 0.0 107.272 177.06 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.133 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.97 138.21 25.35 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.311 178.869 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.87 HD11 HD13 ' B' ' 31' ' ' ILE . 71.8 mt -94.17 104.94 16.94 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.501 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.736 ' HA ' HG22 ' B' ' 74' ' ' THR . 10.7 t -89.09 109.07 19.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.532 HD22 HD13 ' B' ' 50' ' ' ILE . 2.3 mt -93.82 157.26 16.22 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.985 -177.015 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -81.31 1.04 34.39 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.232 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -16.17 59.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.548 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 104.25 7.59 40.15 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.939 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 73' ' ' ASP . . . . . 0.498 ' OD1' HD12 ' B' ' 69' ' ' LEU . 8.7 p-10 -126.37 170.42 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.206 0.527 . . . . 0.0 111.859 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.736 HG22 ' HA ' ' B' ' 68' ' ' VAL . 8.8 p -137.57 131.93 32.39 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.763 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 9.6 m -103.98 112.56 25.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.73 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 1.012 ' HB2' ' HG2' ' A' ' 395' ' ' GLU . 0.7 OUTLIER -84.51 153.87 23.04 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.628 0.728 . . . . 0.0 112.164 -179.007 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.572 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 36.7 m-85 -133.62 111.86 10.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.573 178.043 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.556 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t60 -86.59 98.97 11.38 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.701 -177.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.805 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 41.8 m-85 -77.06 95.57 4.23 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.42 4.97 44.2 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.566 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -80.3 91.35 5.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.125 0.488 . . . . 0.0 110.297 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.18 -42.1 4.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.325 -0.852 . . . . 0.0 113.173 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -59.75 4.72 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.267 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 18.1 p -127.62 8.75 6.43 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.805 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.75 -47.93 7.99 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -178.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.436 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.11 -52.03 65.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.845 0.355 . . . . 0.0 111.016 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.575 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 6.4 mptt -67.67 -35.09 78.21 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.036 0.446 . . . . 0.0 109.817 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.672 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -64.75 -44.79 88.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.426 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.693 ' HD3' HG23 ' B' ' 63' ' ' ILE . 28.3 ttp180 -54.55 -47.64 72.97 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.379 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 90' ' ' ASP . . . . . 0.673 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -61.94 -44.86 95.9 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.293 179.687 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.39 -41.43 80.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 117.79 0.268 . . . . 0.0 111.406 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.92 HG13 HD11 ' B' ' 26' ' ' LEU . 41.1 t -62.42 -42.23 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 177.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.704 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.1 tmmt? -59.43 -56.97 15.26 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.436 177.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.92 -52.99 58.83 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.148 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.777 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.9 tp -61.19 -42.77 99.17 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.038 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.418 HD12 HG12 ' B' ' 92' ' ' VAL . 21.2 mt -68.01 -43.89 77.8 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.18 -24.1 66.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.066 0.936 . . . . 0.0 109.381 178.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -84.9 -49.98 7.91 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.326 -1.306 . . . . 0.0 110.74 178.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.777 HD12 ' HG ' ' B' ' 95' ' ' LEU . 11.9 mt -77.09 -47.28 20.92 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 113.574 -1.648 . . . . 0.0 115.257 -176.469 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.718 HD23 ' HB3' ' B' ' 47' ' ' TYR . 33.0 mt -50.19 -54.8 30.04 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -176.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 25.9 Cg_endo -60.64 -16.49 43.44 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.091 1.861 . . . . 0.0 113.337 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -87.77 -8.73 55.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -119.28 -35.44 3.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.269 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' B' ' 100' ' ' LEU . 62.1 pttt -80.93 114.87 20.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.383 0.611 . . . . 0.0 109.974 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 105' ' ' ARG . . . . . 0.481 ' HA ' ' HD2' ' B' ' 105' ' ' ARG . 8.9 tpt85 -142.43 93.75 2.57 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.479 ' CE ' ' HA ' ' A' ' 410' ' ' ASP . 3.0 pptp? -92.4 -166.62 1.58 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.244 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -78.95 50.07 0.99 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.149 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 14.4 t30 . . . . . 0 C--O 1.243 0.753 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.335 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 7.2 p90 . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.12 135.29 27.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 85.37 -68.05 3.51 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.568 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 395' ' ' GLU . . . . . 0.533 ' HG2' ' CG ' ' B' ' 76' ' ' ASN . 9.8 tp10 -119.49 127.99 53.56 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.231 0.539 . . . . 0.0 110.853 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -136.65 30.62 2.84 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.241 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.749 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 22.9 t70 -50.77 -37.51 42.57 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.06 -178.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.724 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 7.4 tt0 165.9 -95.95 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 177.103 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.975 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.3 tt0 -114.09 95.73 5.45 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.304 -177.549 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.646 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 13.1 p-10 -136.59 93.21 2.84 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.753 0.787 . . . . 0.0 111.803 -178.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.521 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.2 p-10 -139.29 -44.72 0.46 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 16.2 p30 -74.41 12.8 0.69 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.718 0.77 . . . . 0.0 110.103 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.756 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -55.29 121.54 9.13 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.673 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -97.72 133.68 41.92 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.426 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.658 ' HG3' ' HB2' ' A' ' 409' ' ' ASP . 5.6 mm-40 -86.29 171.51 11.17 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.215 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -168.44 -23.91 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.747 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 407' ' ' ASP . . . . . 0.584 ' HB3' ' CB ' ' B' ' 52' ' ' CYS . 17.1 t0 -93.45 -7.07 45.52 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 83.92 121.88 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 113.293 -1.776 . . . . 0.0 113.626 175.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.658 ' HB2' ' HG3' ' A' ' 405' ' ' GLU . 9.4 t0 -99.71 49.27 0.93 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.006 -1.452 . . . . 0.0 111.289 -178.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.246 0.878 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.735 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.7 tpt . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.35 30.72 19.97 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.382 0.611 . . . . 0.0 110.079 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -111.51 -60.27 1.87 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.548 -179.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 4' ' ' SER . . . . . 0.721 ' HB2' ' HG3' ' B' ' 29' ' ' GLU . 7.0 m -80.23 101.51 8.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.343 0.592 . . . . 0.0 110.151 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 5' ' ' SER . . . . . 0.447 ' HB3' ' CZ ' ' B' ' 30' ' ' ARG . 70.5 m -151.89 27.05 0.63 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.516 -179.095 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.33 6.16 7.73 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.921 0.867 . . . . 0.0 109.851 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.468 ' HG2' ' N ' ' B' ' 8' ' ' VAL . 0.0 OUTLIER -123.26 149.39 44.82 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 114.347 -1.297 . . . . 0.0 109.513 -179.034 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.468 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 41.8 t -123.58 117.75 52.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.826 0.346 . . . . 0.0 110.289 179.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 82.4 mt -87.16 -31.93 20.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.711 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.422 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -138.53 134.5 33.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.402 HG23 ' CE1' ' B' ' 25' ' ' TYR . 68.3 mt -117.61 124.18 72.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.753 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.2 t -115.65 149.96 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.652 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.643 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -111.17 179.3 4.08 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.43 -178.943 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.542 ' H ' ' HD2' ' B' ' 14' ' ' LYS . 1.3 mptp? 18.55 70.63 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 O-C-N 124.978 1.424 . . . . 0.0 113.939 -179.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.668 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.0 t -123.39 120.35 59.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.151 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.541 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 3.2 mtm180 -92.38 142.39 27.49 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.198 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.58 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.33 105.38 5.21 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.17 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 mptt 71.91 49.24 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.887 0.742 . . . . 0.0 110.818 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.749 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 7.9 mptt 70.6 27.66 3.72 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.231 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.658 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.8 pt20 -145.98 132.46 19.73 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.911 -0.493 . . . . 0.0 110.649 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -80.06 153.17 28.95 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.967 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.525 ' HA2' ' H ' ' B' ' 36' ' ' GLU . . . -178.09 -162.67 28.35 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.239 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.99 137.44 54.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.062 0.458 . . . . 0.0 109.863 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.917 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.3 tp -98.01 141.51 30.88 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.24 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 25' ' ' TYR . . . . . 0.402 ' CE1' HG23 ' B' ' 11' ' ' ILE . 34.5 m-85 -136.57 113.7 10.61 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.796 HD11 HG13 ' B' ' 92' ' ' VAL . 14.7 mt -90.53 130.99 36.52 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.34 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 15.0 mtt -112.13 159.89 18.09 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.03 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.3 -40.31 5.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.721 ' HG3' ' HB2' ' B' ' 4' ' ' SER . 20.7 mt-10 -119.53 -4.44 10.34 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.447 ' CZ ' ' HB3' ' B' ' 5' ' ' SER . 27.2 ptt180 -151.72 158.63 43.64 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.534 -177.75 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 1.016 HD13 HD11 ' B' ' 67' ' ' LEU . 1.7 tt -107.83 120.49 59.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -120.26 146.85 45.67 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.001 0.429 . . . . 0.0 110.694 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.917 ' HB2' HD12 ' B' ' 24' ' ' LEU . 24.1 t90 -146.83 140.07 25.48 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.574 ' HB2' ' HA ' ' B' ' 41' ' ' PHE . . . -133.93 141.05 38.3 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.798 -179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.507 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 14.3 Cg_exo -65.94 141.51 64.96 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.383 2.055 . . . . 0.0 110.522 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.525 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 4.4 mt-10 -64.57 116.0 5.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.318 0.58 . . . . 0.0 109.589 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 109.61 3.29 30.62 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.569 ' HA ' ' NZ ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -107.14 148.5 28.75 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.403 0.62 . . . . 0.0 111.306 179.467 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -93.32 -22.35 19.02 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.473 -1.24 . . . . 0.0 111.828 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.1 133.77 55.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.73 0.3 . . . . 0.0 111.174 -178.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.574 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 75.2 m-85 -68.66 120.98 15.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 42' ' ' THR . . . . . 0.437 ' OG1' ' HD3' ' B' ' 35' ' ' PRO . 0.8 OUTLIER -79.91 -39.33 30.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.023 0.44 . . . . 0.0 110.638 -179.799 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.65 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 17.6 mm -93.08 119.12 40.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.954 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -147.95 101.22 3.28 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.472 ' CD2' HG23 ' B' ' 43' ' ' ILE . 52.3 m-70 -132.05 143.32 49.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.935 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.4 ' O ' HG12 ' B' ' 50' ' ' ILE . 5.9 mtp -91.36 145.16 24.87 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.002 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.742 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.51 -21.69 39.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.045 0.45 . . . . 0.0 110.413 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.65 -10.7 59.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.992 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.593 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.01 -4.59 17.69 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.315 0.578 . . . . 0.0 109.831 179.624 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.702 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.7 mm -90.3 132.84 33.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.541 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 17.7 ttpt -88.86 -41.84 12.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.274 0.559 . . . . 0.0 109.713 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.734 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 24.3 p -162.35 -178.0 6.03 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.403 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -146.73 139.24 25.01 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.741 0.305 . . . . 0.0 110.853 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.049 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 19.0 mttp -109.58 156.5 20.1 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.545 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.37 128.09 63.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 176.048 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -89.03 118.92 69.68 Favored Pre-proline 0 C--O 1.249 1.036 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.243 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.32 173.18 13.49 Favored 'Trans proline' 0 C--O 1.234 0.316 1 C-N-CA 125.311 4.008 . . . . 0.0 114.559 -177.322 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -60.21 160.98 7.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.201 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.31 -29.14 7.82 Favored Glycine 0 C--N 1.316 -0.53 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.975 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 10.0 mttp -90.7 154.0 19.87 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 2.76 8.49 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.236 0.541 . . . . 0.0 110.502 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.23 148.04 32.08 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.526 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.636 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -96.86 136.54 27.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.405 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 10.5 mt-30 -138.7 163.24 32.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.585 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.6 153.59 47.4 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 113.812 -1.54 . . . . 0.0 106.862 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.049 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -145.99 134.49 22.03 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 119.302 0.955 . . . . 0.0 111.266 178.845 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 1.016 HD11 HD13 ' B' ' 31' ' ' ILE . 26.0 mt -94.15 104.15 16.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.768 178.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.734 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -88.62 103.73 14.1 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.592 HD22 HD13 ' B' ' 50' ' ' ILE . 2.4 mt -89.25 157.86 18.07 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.05 -177.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.593 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.3 0.27 37.77 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.018 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.79 -10.16 59.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.15 11.57 54.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.002 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -126.41 154.72 43.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.563 HG22 ' HA ' ' B' ' 68' ' ' VAL . 13.7 p -124.11 131.01 53.5 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.584 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 1.4 m -103.64 98.63 8.48 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.535 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 4.8 m-20 -85.74 122.36 29.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.404 0.621 . . . . 0.0 111.885 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.632 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 63.0 m-85 -103.81 113.37 26.85 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.008 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.668 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.9 t60 -86.59 100.0 12.11 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.041 -178.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.684 ' CE1' HG11 ' B' ' 12' ' ' VAL . 54.8 m-85 -76.84 88.18 3.44 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.09 13.09 35.69 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.536 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.8 t-20 -83.22 92.94 7.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.318 0.58 . . . . 0.0 109.933 179.348 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.06 -34.9 0.79 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.84 -59.57 3.42 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -178.363 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.514 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -127.36 11.6 6.92 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -176.151 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.9 -47.87 11.24 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.043 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.96 -52.1 65.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.887 0.375 . . . . 0.0 110.817 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.514 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.8 mttt -66.6 -34.11 77.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.922 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.63 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.1 mt-10 -65.71 -44.44 86.08 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.636 ' HD3' HG23 ' B' ' 63' ' ' ILE . 26.2 ttp180 -56.29 -47.86 77.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 90' ' ' ASP . . . . . 0.545 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.43 -44.38 96.55 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 113.865 -1.516 . . . . 0.0 112.381 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.14 -44.46 79.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.767 0.258 . . . . 0.0 111.312 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.796 HG13 HD11 ' B' ' 26' ' ' LEU . 48.9 t -60.33 -44.09 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.545 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.1 tmmt? -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.724 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -55.53 25.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.895 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.683 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.4 tp -63.26 -32.56 74.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.139 -179.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.515 HD12 HG12 ' B' ' 92' ' ' VAL . 20.9 mt -76.36 -39.26 54.32 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -66.08 -18.58 65.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.289 1.042 . . . . 0.0 108.621 178.393 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -87.88 -48.4 7.84 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.521 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.683 HD12 ' HG ' ' B' ' 95' ' ' LEU . 16.3 mt -82.8 -37.32 24.68 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 -176.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.742 HD23 ' HB3' ' B' ' 47' ' ' TYR . 66.4 mt -63.48 -58.44 15.48 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.689 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 37.7 Cg_exo -58.57 -23.49 65.23 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.245 1.964 . . . . 0.0 113.499 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.526 ' HG2' ' HA ' ' B' ' 99' ' ' LEU . 2.3 ptmm? -88.15 1.37 54.52 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.467 ' HD1' ' O ' ' B' ' 99' ' ' LEU . 21.6 m-85 -124.26 -35.66 2.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.705 0.288 . . . . 0.0 111.132 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -81.8 161.09 23.37 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 105' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' B' ' 108' ' ' ASN . 0.3 OUTLIER -62.75 -50.98 68.93 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 106' ' ' LYS . . . . . 0.787 ' HA ' ' HE3' ' B' ' 106' ' ' LYS . 0.1 OUTLIER 179.92 -68.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.59 178.739 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -120.62 13.29 11.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.978 0.894 . . . . 0.0 108.812 178.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.451 ' O ' ' HB2' ' B' ' 105' ' ' ARG . 4.7 p-10 . . . . . 0 C--O 1.253 1.288 0 CA-C-N 113.912 -1.495 . . . . 0.0 108.212 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 22.5 p90 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 42.4 t -64.64 112.65 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 179.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 101.53 -80.81 0.42 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -99.11 131.66 44.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.144 0.497 . . . . 0.0 109.776 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 396' ' ' ASP . . . . . 0.514 ' C ' ' H ' ' A' ' 398' ' ' GLU . 4.2 t70 -136.67 31.0 2.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.797 -179.094 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 0.4 OUTLIER -64.51 16.61 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -178.837 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.514 ' H ' ' C ' ' A' ' 396' ' ' ASP . 8.4 tt0 108.15 -68.9 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.655 1.582 . . . . 0.0 113.186 175.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.945 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.7 tt0 -148.72 93.09 2.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.92 0.39 . . . . 0.0 110.916 -177.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.611 ' HB2' ' CE2' ' A' ' 403' ' ' PHE . 11.8 p-10 -134.0 94.46 3.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.76 0.79 . . . . 0.0 111.857 -178.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.496 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.42 -46.98 0.46 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -73.31 12.09 0.64 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.377 0.608 . . . . 0.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 0.674 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -53.29 115.96 2.17 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.596 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -78.73 136.62 37.46 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 1.036 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -148.98 -178.52 6.41 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.576 1.324 . . . . 0.0 114.576 -176.733 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 406' ' ' ASN . . . . . 0.427 ' C ' ' H ' ' A' ' 408' ' ' GLU . 24.7 p-10 -154.77 62.4 0.66 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 111.977 -2.374 . . . . 0.0 105.183 177.013 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 407' ' ' ASP . . . . . 0.574 ' HA ' ' SG ' ' B' ' 52' ' ' CYS . 0.1 OUTLIER -59.21 14.11 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -176.429 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 408' ' ' GLU . . . . . 0.492 ' H ' ' HG3' ' A' ' 408' ' ' GLU . 1.6 mt-10 -63.27 -76.09 0.07 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -175.78 72.61 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.862 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.751 ' HB3' ' HA ' ' B' ' 52' ' ' CYS . 16.1 t70 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.057 -179.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.481 1.091 0 CA-C-O 120.67 0.271 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.02 100.07 2.0 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.4 44.61 7.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.708 0.766 . . . . 0.0 109.854 -179.019 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.29 15.1 23.85 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.795 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 5' ' ' SER . . . . . 0.454 ' HA ' ' CD ' ' B' ' 29' ' ' GLU . 16.2 m 67.76 19.49 9.64 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.301 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.552 ' OE2' ' HA ' ' B' ' 6' ' ' GLU . 2.7 mm-40 -146.52 19.87 1.34 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.598 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.647 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.4 OUTLIER -81.76 101.11 9.91 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.472 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 90.9 t -81.82 117.45 27.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.371 0.605 . . . . 0.0 111.477 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.508 ' HB2' HD21 ' B' ' 95' ' ' LEU . 23.4 mt -97.79 -31.61 12.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.34 179.138 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.3 tp -132.97 137.8 46.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.8 mt -122.34 121.59 64.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.737 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.5 t -110.6 148.67 13.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.136 -179.373 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.559 ' HD3' ' N ' ' B' ' 13' ' ' LYS . 0.1 OUTLIER -108.3 174.09 6.03 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.673 -178.78 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 18.0 70.05 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 O-C-N 125.084 1.49 . . . . 0.0 114.27 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.558 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.1 t -116.21 120.98 66.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.612 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 31.9 mtp180 -96.7 119.85 35.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.154 0.502 . . . . 0.0 110.953 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' B' ' 76' ' ' ASN . 10.7 tm0? -109.98 119.84 40.58 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.601 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 65.56 33.52 8.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -178.262 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.35 18.65 7.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.332 -1.304 . . . . 0.0 111.552 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tp-100 -110.12 119.1 38.21 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.33 144.4 56.59 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.741 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . -178.92 -165.94 34.12 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.409 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.59 136.81 53.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.071 0.462 . . . . 0.0 109.897 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.948 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.81 142.22 29.84 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.4 -177.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -135.03 124.16 24.38 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.845 HD11 HG13 ' B' ' 92' ' ' VAL . 19.3 mt -105.3 121.11 43.19 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.643 -178.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.647 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.3 mpt? -97.88 159.13 15.13 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.79 -21.54 56.27 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.454 ' CD ' ' HA ' ' B' ' 5' ' ' SER . 3.9 mp0 -116.87 -16.85 10.55 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.503 HH21 ' CD ' ' B' ' 6' ' ' GLU . 12.8 ptt180 -154.84 164.73 38.4 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.374 -176.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 1.005 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -114.32 122.55 68.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.233 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -125.45 152.55 44.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.033 0.444 . . . . 0.0 110.512 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.948 ' HB2' HD12 ' B' ' 24' ' ' LEU . 21.9 t90 -146.87 136.81 23.3 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.453 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -122.38 135.35 25.46 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.185 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 1.081 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 4.8 Cg_exo -72.08 150.09 53.57 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.54 2.16 . . . . 0.0 111.803 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.741 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.1 mt-10 -63.66 124.41 21.36 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.928 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.59 6.47 62.43 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 1.081 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 10.0 mptt -113.32 149.71 33.57 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -97.06 -1.39 45.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.888 -178.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -132.63 151.07 52.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.169 0.509 . . . . 0.0 112.055 -178.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.422 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 44.1 m-85 -83.88 121.26 27.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.678 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.1 p -87.53 -21.85 25.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.208 0.528 . . . . 0.0 110.487 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.608 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 11.5 mm -102.39 122.98 55.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.23 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.3 t -147.68 101.56 3.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.183 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.503 ' CD2' HG23 ' B' ' 43' ' ' ILE . 51.0 m-70 -133.99 139.44 46.06 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.473 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.4 mtp -96.94 148.68 22.71 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.659 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.4 m-85 -58.18 -23.2 54.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.853 0.359 . . . . 0.0 111.287 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.99 -25.28 62.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.053 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.599 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -97.15 -4.76 38.66 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.823 0.344 . . . . 0.0 110.833 -179.614 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.564 HD13 HD22 ' B' ' 69' ' ' LEU . 4.1 mm -83.45 131.48 33.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.458 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 13.7 tttm -91.94 -37.19 13.01 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.73 0.3 . . . . 0.0 110.352 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.751 ' HA ' ' HB3' ' A' ' 410' ' ' ASP . 1.6 p -169.39 179.97 3.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -139.83 143.83 37.0 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.271 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.125 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 16.9 mttm -115.3 150.1 36.78 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.526 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -130.57 129.25 64.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.653 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.471 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -91.34 121.15 67.99 Favored Pre-proline 0 C--O 1.249 1.028 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.283 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -72.56 173.44 13.27 Favored 'Trans proline' 0 C--O 1.234 0.318 1 C-N-CA 125.586 4.191 . . . . 0.0 114.733 -177.539 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -58.67 160.64 5.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.407 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.92 -29.01 8.03 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 -178.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.945 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.9 mttp -89.81 154.62 19.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.404 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.3 -11.85 61.18 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.216 0.532 . . . . 0.0 110.299 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.659 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.15 140.84 40.04 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.769 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.57 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.3 mp -85.21 140.3 16.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 64' ' ' GLN . . . . . 0.471 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 91.7 mt-30 -139.94 163.18 33.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.473 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.3 tp -142.54 153.54 43.67 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.339 176.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.125 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 137.22 23.73 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 119.241 0.928 . . . . 0.0 110.939 178.281 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 1.005 HD11 HD13 ' B' ' 31' ' ' ILE . 96.4 mt -94.14 104.09 16.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.869 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.588 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 5.7 t -88.59 110.78 21.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.564 HD22 HD13 ' B' ' 50' ' ' ILE . 4.4 mt -97.57 155.9 16.76 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.075 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.6 OUTLIER -81.67 2.95 27.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.013 178.218 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.85 -5.83 59.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.157 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.31 16.14 53.94 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.547 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -126.12 154.3 43.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.759 0.314 . . . . 0.0 110.775 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.549 HG22 ' HA ' ' B' ' 68' ' ' VAL . 17.0 p -130.23 130.71 44.95 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.59 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.2 m -106.56 98.98 8.58 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.62 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.494 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 5.3 m-20 -82.41 147.09 28.97 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.848 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.51 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 59.2 m-85 -131.24 112.71 13.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.834 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.612 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.5 t-80 -87.03 99.91 12.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.285 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.692 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 43.1 m-85 -75.07 100.02 4.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.53 11.4 28.76 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -85.66 91.66 8.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.243 0.544 . . . . 0.0 109.733 179.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.58 -34.23 2.07 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.23 -57.66 7.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.511 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.48 8.72 6.5 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -176.322 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.692 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.93 -47.27 8.43 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -178.208 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 t -59.84 -54.18 38.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.915 0.388 . . . . 0.0 110.747 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -65.55 -33.36 75.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.959 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.674 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.7 mt-10 -66.09 -45.39 81.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.57 ' HD3' HG23 ' B' ' 63' ' ' ILE . 17.6 ttp180 -56.06 -47.91 77.04 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 90' ' ' ASP . . . . . 0.725 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -61.22 -44.19 97.67 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 113.619 -1.628 . . . . 0.0 111.96 179.797 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.61 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.704 0.229 . . . . 0.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.845 HG13 HD11 ' B' ' 26' ' ' LEU . 45.4 t -62.81 -44.69 99.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.725 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.8 OUTLIER -58.82 -52.68 64.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.793 178.254 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 94' ' ' ASP . . . . . 0.457 ' HA ' ' HG2' ' B' ' 97' ' ' GLN . 1.2 m-20 -58.67 -53.29 59.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.81 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.718 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.2 tp -60.64 -38.58 85.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.401 HD12 HG12 ' B' ' 92' ' ' VAL . 25.8 mt -70.15 -45.44 66.76 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 178.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 97' ' ' GLN . . . . . 0.457 ' HG2' ' HA ' ' B' ' 94' ' ' ASP . 19.7 pt20 -64.85 -18.07 64.83 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.218 1.009 . . . . 0.0 109.195 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -85.91 -49.78 7.61 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.928 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.718 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -78.96 -47.25 16.68 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.473 -1.694 . . . . 0.0 115.146 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.659 HD23 ' HB3' ' B' ' 47' ' ' TYR . 34.9 mt -52.23 -56.3 23.43 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.295 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 32.2 Cg_exo -61.59 -13.43 29.72 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.398 2.065 . . . . 0.0 113.417 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 7.9 mtmm -85.48 -23.17 27.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.982 0.42 . . . . 0.0 110.285 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -120.08 21.11 11.94 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.657 ' HA ' ' HE3' ' B' ' 104' ' ' LYS . 0.4 OUTLIER -57.95 101.15 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.019 -0.991 . . . . 0.0 112.285 -178.277 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -146.07 -144.81 0.16 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.231 -0.895 . . . . 0.0 108.869 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -144.13 97.51 3.06 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . 73.84 -175.33 0.15 Allowed 'General case' 0 C--O 1.235 0.33 0 O-C-N 124.409 1.068 . . . . 0.0 110.999 -179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.605 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 392' ' ' TYR . . . . . 0.868 ' HE2' ' HA ' ' A' ' 399' ' ' GLU . 7.5 p90 . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 393' ' ' VAL . . . . . 0.406 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 24.7 t -61.74 119.75 6.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.646 0.26 . . . . 0.0 110.488 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 96.03 -82.22 0.8 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.785 -0.721 . . . . 0.0 111.62 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -108.65 144.1 36.85 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -129.71 30.08 4.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.485 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.562 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 1.7 t70 -66.81 -31.88 72.8 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 398' ' ' GLU . . . . . 0.588 ' HB3' ' HE3' ' B' ' 62' ' ' LYS . 1.1 tm-20 167.53 -60.86 0.01 OUTLIER 'General case' 0 C--O 1.232 0.134 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.074 177.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 399' ' ' GLU . . . . . 0.869 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 63.0 tt0 -168.62 100.51 0.4 Allowed 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 400' ' ' ASP . . . . . 0.631 ' HB3' ' CD1' ' A' ' 403' ' ' PHE . 0.8 OUTLIER -133.67 90.74 2.75 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -175.513 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 401' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -138.99 -48.41 0.5 Allowed 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -72.06 13.59 0.29 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.929 0.871 . . . . 0.0 110.538 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 403' ' ' PHE . . . . . 1.004 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -61.68 119.39 8.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.192 -1.367 . . . . 0.0 111.025 179.553 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -108.53 133.34 52.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.775 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 405' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 1.8 pt-20 -114.85 -112.94 0.34 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.514 0.197 . . . . 0.0 110.91 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.06 -172.32 3.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.938 0.399 . . . . 0.0 110.911 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -112.12 -2.96 14.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.591 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.07 163.14 19.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.106 0.479 . . . . 0.0 111.826 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 409' ' ' ASP . . . . . 0.471 ' CG ' HH12 ' B' ' 105' ' ' ARG . 29.5 p-10 -95.16 -42.88 8.35 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 410' ' ' ASP . . . . . 0.678 ' HA ' ' NZ ' ' B' ' 104' ' ' LYS . 7.5 t70 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.112 -0.947 . . . . 0.0 111.423 177.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 43.6 ttm . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.69 23.92 0.18 Allowed 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 6.2 m 63.63 61.91 0.97 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.388 0.613 . . . . 0.0 111.526 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.01 -50.16 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.981 179.221 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 63.0 m -156.91 78.89 0.91 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' GLU . . . . . 0.849 ' HB2' ' HB3' ' B' ' 27' ' ' MET . 2.2 mm-40 -78.18 161.33 27.42 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.18 -176.574 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.425 ' O ' ' HA ' ' B' ' 27' ' ' MET . 1.9 mp0 -63.9 111.28 2.41 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.378 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.42 HG11 HG12 ' B' ' 11' ' ' ILE . 63.9 t -82.48 104.24 10.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.7 mt -82.78 -31.11 28.42 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.515 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.6 tp -132.53 123.03 25.74 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.42 HG12 HG11 ' B' ' 8' ' ' VAL . 73.1 mt -109.6 120.64 61.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 177.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 12' ' ' VAL . . . . . 0.758 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.0 t -112.91 149.62 15.32 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 13' ' ' LYS . . . . . 0.61 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -109.48 -179.94 3.97 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.984 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.429 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.8 mttp 17.95 76.31 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 125.393 1.683 . . . . 0.0 113.533 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.61 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.6 t -127.9 125.0 64.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.596 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 1.4 mtt-85 -99.04 146.11 26.39 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.388 0.614 . . . . 0.0 112.201 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 17' ' ' GLN . . . . . 0.536 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 53.1 tp60 -119.75 102.71 8.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 1.1 mptp? 55.61 56.73 5.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.104 -178.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.562 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 3.2 mptm? 76.33 9.75 3.1 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 178.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 20' ' ' GLN . . . . . 0.691 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 5.9 pt20 -119.56 119.65 34.41 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.173 0.897 . . . . 0.0 110.755 178.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.538 ' OD2' ' HD3' ' B' ' 16' ' ' ARG . 2.1 m-20 -72.42 149.68 44.04 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.639 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -175.98 -161.31 24.97 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.744 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.36 139.45 53.66 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.884 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.75 137.28 39.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.743 -178.547 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -133.46 108.72 8.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.826 0.346 . . . . 0.0 110.412 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.954 HD11 HG13 ' B' ' 92' ' ' VAL . 10.7 mt -84.59 121.42 27.6 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.905 0.383 . . . . 0.0 110.332 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 27' ' ' MET . . . . . 0.849 ' HB3' ' HB2' ' B' ' 6' ' ' GLU . 0.5 OUTLIER -99.38 166.32 11.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.486 -178.802 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.2 -52.99 8.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.454 ' CD ' HH21 ' B' ' 30' ' ' ARG . 1.5 mp0 -114.2 7.03 16.46 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.016 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.502 ' NE ' ' HG3' ' B' ' 6' ' ' GLU . 10.1 ptp180 -158.94 157.86 32.2 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.513 -0.875 . . . . 0.0 112.682 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 31' ' ' ILE . . . . . 0.966 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -103.68 119.03 51.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.345 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.529 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -115.31 147.07 40.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.911 0.386 . . . . 0.0 110.801 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 33' ' ' TRP . . . . . 0.884 ' HB2' HD12 ' B' ' 24' ' ' LEU . 35.9 t90 -147.18 145.46 29.51 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.269 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 1.064 ' HB1' ' HG3' ' B' ' 38' ' ' LYS . . . -145.44 133.23 10.45 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.746 -0.206 . . . . 0.0 111.183 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 35' ' ' PRO . . . . . 0.639 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 69.7 Cg_endo -70.68 132.77 22.48 Favored 'Trans proline' 0 N--CA 1.476 0.474 0 C-N-CA 123.457 2.771 . . . . 0.0 111.79 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.546 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 0.0 OUTLIER -50.3 132.17 24.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.194 -178.453 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.73 11.03 39.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -177.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 1.064 ' HG3' ' HB1' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -99.62 166.7 11.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.585 -0.807 . . . . 0.0 111.953 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -124.22 -4.98 7.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.444 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -146.2 164.09 33.35 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.259 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.66 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 36.2 m-85 -88.22 130.86 34.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.229 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.3 p -94.33 -25.92 16.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.56 . . . . 0.0 110.32 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.768 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -106.04 120.68 57.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.302 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 45.8 t -147.91 101.43 3.3 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 45' ' ' HIS . . . . . 0.422 ' CD2' HG23 ' B' ' 43' ' ' ILE . 79.9 m-70 -123.33 137.96 54.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 46' ' ' MET . . . . . 0.472 ' O ' HG12 ' B' ' 50' ' ' ILE . 70.9 mmm -85.9 140.91 29.96 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.709 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.9 m-85 -57.66 -22.85 48.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.969 0.414 . . . . 0.0 110.501 179.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.77 -22.31 60.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.807 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.617 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -96.32 -6.82 36.87 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.11 0.481 . . . . 0.0 110.067 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.64 ' HB ' HD22 ' B' ' 100' ' ' LEU . 4.4 mm -87.28 118.22 32.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.618 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 0.6 OUTLIER -79.39 -30.88 42.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.226 0.536 . . . . 0.0 109.615 -178.655 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.618 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 9.4 p -176.1 173.69 2.17 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.751 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 18.8 pm0 -132.42 137.91 47.46 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.199 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 1.137 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -104.75 148.97 26.02 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.517 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.8 OUTLIER -127.25 127.04 68.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 175.998 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -88.3 116.66 66.88 Favored Pre-proline 0 C--O 1.252 1.188 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.83 173.3 11.23 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 125.211 3.941 . . . . 0.0 114.484 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -60.73 160.33 9.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.47 -29.06 8.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.331 -1.507 . . . . 0.0 109.331 -177.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.869 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.5 mttp -88.45 152.26 22.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 176.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.4 -8.98 51.42 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 121.127 0.489 . . . . 0.0 110.942 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.588 ' HE3' ' HB3' ' A' ' 398' ' ' GLU . 0.0 OUTLIER -141.74 140.8 33.2 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.597 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 63' ' ' ILE . . . . . 0.594 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.4 mp -86.31 135.49 24.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 178.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -139.5 163.31 32.88 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 118.897 -1.121 . . . . 0.0 113.992 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 1.7 tp -138.88 153.07 48.26 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.054 -1.43 . . . . 0.0 107.522 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 1.137 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 142.96 28.3 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 119.25 0.932 . . . . 0.0 111.183 178.201 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.966 HD11 HD13 ' B' ' 31' ' ' ILE . 95.7 mt -95.29 103.13 14.98 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.925 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.743 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.3 t -87.12 115.94 28.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.534 HD22 HD13 ' B' ' 50' ' ' ILE . 4.1 mt -101.13 154.87 18.36 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.11 0.481 . . . . 0.0 111.952 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.617 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.43 -1.95 36.05 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.384 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.99 -15.3 61.1 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.63 178.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 102.8 7.45 44.61 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.929 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 73' ' ' ASP . . . . . 0.488 ' OD2' HD12 ' B' ' 69' ' ' LEU . 4.8 p-10 -126.44 167.71 15.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.117 0.484 . . . . 0.0 111.572 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 74' ' ' THR . . . . . 0.743 HG22 ' HA ' ' B' ' 68' ' ' VAL . 33.2 p -136.63 131.45 33.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.752 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 75' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.2 m -100.57 99.33 9.89 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 178.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 76' ' ' ASN . . . . . 0.44 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.5 m-20 -82.46 148.17 28.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.238 0.542 . . . . 0.0 111.485 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 77' ' ' PHE . . . . . 0.768 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 54.0 m-85 -131.59 113.99 14.3 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.767 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.563 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.8 t-160 -87.05 105.3 17.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.447 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.751 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 29.0 m-85 -76.41 97.48 4.29 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.401 ' HB3' ' CZ ' ' B' ' 16' ' ' ARG . 0.6 OUTLIER -95.18 7.27 46.67 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.922 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 81' ' ' ASN . . . . . 0.429 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 54.7 t30 -81.35 91.19 6.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.128 0.49 . . . . 0.0 110.451 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.66 -24.97 9.52 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.209 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -59.98 2.46 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 84' ' ' THR . . . . . 0.525 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.7 p -127.82 13.46 6.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -176.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 85' ' ' ALA . . . . . 0.751 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -46.15 -44.36 15.79 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.447 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.6 -53.52 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.027 0.442 . . . . 0.0 110.488 179.541 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.525 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.48 -34.91 78.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.264 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 88' ' ' GLU . . . . . 0.672 ' O ' HG23 ' B' ' 92' ' ' VAL . 13.5 mt-10 -67.5 -44.22 78.99 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 89' ' ' ARG . . . . . 0.594 ' HD3' HG23 ' B' ' 63' ' ' ILE . 22.5 ttp180 -55.42 -47.08 76.52 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.133 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -42.28 99.27 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.57 -1.65 . . . . 0.0 112.466 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.47 -43.65 76.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.72 0.236 . . . . 0.0 111.078 179.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.954 HG13 HD11 ' B' ' 26' ' ' LEU . 35.2 t -60.28 -44.45 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 177.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' B' ' 97' ' ' GLN . 0.5 OUTLIER -58.18 -54.87 42.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.089 178.337 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 94' ' ' ASP . . . . . 0.452 ' HA ' ' OE1' ' B' ' 97' ' ' GLN . 4.2 m-20 -56.73 -53.95 51.88 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.195 -179.069 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.646 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.5 tp -61.56 -32.67 72.76 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.472 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.63 -41.12 65.86 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 97' ' ' GLN . . . . . 0.452 ' OE1' ' HA ' ' B' ' 94' ' ' ASP . 58.2 mt-30 -63.08 -22.67 67.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.149 0.976 . . . . 0.0 108.684 178.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.63 -47.42 9.2 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.793 -1.549 . . . . 0.0 111.439 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 99' ' ' LEU . . . . . 0.646 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.7 mt -80.05 -47.76 14.35 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.124 -1.398 . . . . 0.0 114.757 -176.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.896 ' HB3' ' HD2' ' B' ' 104' ' ' LYS . 59.2 mt -52.55 -56.97 17.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -176.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.652 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.1 Cg_exo -56.83 -13.19 10.74 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.711 2.274 . . . . 0.0 113.875 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -87.15 -9.5 55.09 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.368 -0.208 . . . . 0.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -123.94 -20.86 5.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.496 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.896 ' HD2' ' HB3' ' B' ' 100' ' ' LEU . 5.7 mtpm? -75.25 -178.99 4.19 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.925 0.393 . . . . 0.0 110.902 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 105' ' ' ARG . . . . . 0.471 HH12 ' CG ' ' A' ' 409' ' ' ASP . 0.3 OUTLIER -55.7 145.87 22.69 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.462 178.584 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.51 75.27 10.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -178.267 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -123.08 15.39 9.9 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 176.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 1.7 p30 . . . . . 0 C--N 1.32 -0.696 0 CA-C-N 112.805 -1.998 . . . . 0.0 107.932 -178.611 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.984 ' HG3' ' HE2' ' B' ' 62' ' ' LYS . 0.5 OUTLIER . . . . . 0 CA--C 1.51 -0.567 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -138.44 84.46 2.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.203 -178.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.544 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -139.09 -49.49 0.51 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.234 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -71.29 11.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.602 0.715 . . . . 0.0 110.177 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.728 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -54.76 114.12 1.59 Allowed 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.186 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 . . . . . 0 C--N 1.317 -0.835 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.268 -177.88 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 99.0 t . . . . . 0 N--CA 1.452 -0.356 0 CA-C-O 121.19 0.519 . . . . 0.0 111.471 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.5 mt -95.57 -29.51 14.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.498 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.605 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.07 123.91 26.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.749 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.442 HG23 ' CE1' ' B' ' 25' ' ' TYR . 55.5 mt -108.95 122.65 63.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.839 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.9 t -115.07 150.05 17.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.611 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.66 177.25 4.74 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.064 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.579 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.15 75.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 125.555 1.784 . . . . 0.0 112.971 -178.654 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.611 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.1 t -123.82 119.7 57.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.1 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.593 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 30.8 mtp180 -89.42 128.42 35.94 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.858 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -126.9 104.33 7.97 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.68 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.22 50.88 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.771 179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.26 26.13 10.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.752 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.523 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.1 tt0 -138.31 121.59 17.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.776 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.436 ' HA ' ' HA ' ' B' ' 16' ' ' ARG . 2.1 t70 -76.94 154.0 34.06 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.894 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -178.27 -156.12 15.97 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.218 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 133.57 48.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.955 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.47 142.19 29.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.516 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . 0.442 ' CE1' HG23 ' B' ' 11' ' ' ILE . 50.3 m-85 -137.72 110.59 7.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.97 HD11 HG13 ' B' ' 92' ' ' VAL . 9.3 mt -87.97 128.45 35.38 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 12.5 mtt -108.24 166.6 10.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.63 -47.91 14.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -117.11 3.68 12.71 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -156.11 153.24 29.02 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.624 -0.83 . . . . 0.0 112.515 -177.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.998 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.78 121.43 52.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.09 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.08 153.74 37.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.913 0.387 . . . . 0.0 110.783 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.955 ' HB2' HD12 ' B' ' 24' ' ' LEU . 45.6 t90 -147.26 134.17 20.21 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.475 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -111.98 127.41 26.9 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.714 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.502 ' HG2' ' HB2' ' B' ' 38' ' ' LYS . 58.9 Cg_endo -75.05 142.69 28.0 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.461 2.107 . . . . 0.0 111.801 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -58.77 133.6 56.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.721 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.11 -5.81 75.66 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.398 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.502 ' HB2' ' HG2' ' B' ' 35' ' ' PRO . 1.7 mppt? -113.39 153.55 28.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -98.04 -11.94 22.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.3 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -118.66 152.9 35.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.081 0.467 . . . . 0.0 112.002 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.475 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 21.7 m-85 -81.19 122.8 27.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.6 p -91.58 -8.72 46.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.269 0.557 . . . . 0.0 110.328 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.684 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 15.2 mm -117.08 119.54 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.189 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.3 t -148.0 101.52 3.3 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.474 ' CD2' HG23 ' B' ' 43' ' ' ILE . 73.8 m-70 -124.87 137.72 54.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.004 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.485 ' HB2' ' OD2' ' B' ' 49' ' ' ASP . 21.6 mmm -86.53 140.27 30.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.645 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.7 m-85 -57.56 -23.08 48.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.846 0.355 . . . . 0.0 110.544 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.13 -20.48 61.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.968 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.579 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -98.55 -8.89 25.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.087 0.47 . . . . 0.0 110.318 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.693 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.7 mm -87.43 127.66 40.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.434 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 7.6 tttp -88.44 -46.67 8.95 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.548 0.689 . . . . 0.0 109.727 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.667 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.8 p -154.48 -177.9 6.78 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.145 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . 0.598 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 10.3 pt20 -144.18 143.34 31.04 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.717 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.002 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 25.7 mttp -113.08 153.04 28.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.501 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -130.06 127.04 62.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 176.202 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -87.51 120.0 70.95 Favored Pre-proline 0 C--O 1.249 1.041 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.51 172.94 12.41 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 124.864 3.709 . . . . 0.0 113.928 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -61.76 160.3 12.06 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.888 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.01 8.1 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.59 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 5.2 mttp -85.11 162.96 19.06 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.26 -5.85 46.76 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.308 0.575 . . . . 0.0 110.478 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.984 ' HE2' ' HG3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -146.86 157.73 43.73 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.373 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.611 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -96.64 134.44 34.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.563 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 24.0 mt-30 -135.5 163.24 30.52 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.596 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -141.83 153.22 44.34 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 113.547 -1.66 . . . . 0.0 107.377 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.002 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -146.54 139.68 25.58 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 119.052 0.842 . . . . 0.0 111.256 178.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.998 HD11 HD13 ' B' ' 31' ' ' ILE . 96.2 mt -94.23 104.58 16.58 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.77 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.667 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.5 t -91.36 111.71 24.28 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.482 HD22 HD13 ' B' ' 50' ' ' ILE . 5.2 mt -94.23 157.57 15.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.579 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -79.02 -4.77 51.73 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.423 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.8 -5.61 53.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.636 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.6 20.69 50.45 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . 0.409 ' HB3' HD12 ' B' ' 69' ' ' LEU . 20.9 t70 -125.91 158.78 34.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.354 -0.423 . . . . 0.0 110.415 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.552 HG22 ' HA ' ' B' ' 68' ' ' VAL . 16.1 p -137.5 131.14 31.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.836 0.351 . . . . 0.0 110.316 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.539 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.13 101.09 10.6 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.062 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.51 137.92 32.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.207 0.527 . . . . 0.0 111.719 -178.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.684 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 53.2 m-85 -122.77 111.46 16.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.899 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.593 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.8 t-160 -88.43 104.14 16.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.132 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.596 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 58.4 m-85 -75.09 100.22 4.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.14 -2.02 47.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.579 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.2 t-20 -79.78 91.29 5.31 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.27 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.86 -37.77 9.32 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 52.4 m -53.85 -59.42 4.65 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.534 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.6 p -127.57 9.94 6.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -176.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.512 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.41 -48.9 7.17 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.549 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.1 -51.87 67.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.983 0.421 . . . . 0.0 110.87 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.534 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 7.6 mttt -67.48 -34.92 78.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.053 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.661 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.9 mt-10 -64.64 -46.86 80.73 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.611 ' HD3' HG23 ' B' ' 63' ' ' ILE . 25.3 ttp180 -53.83 -47.73 70.63 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.88 -46.47 87.7 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.6 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.08 -42.39 89.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 118.137 0.426 . . . . 0.0 111.164 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.97 HG13 HD11 ' B' ' 26' ' ' LEU . 47.9 t -60.95 -43.87 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.598 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.3 ttpm? -59.52 -55.21 37.49 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.843 178.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.75 -54.12 42.65 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.908 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.733 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.5 tp -61.99 -38.36 88.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.807 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.411 HD12 HG12 ' B' ' 92' ' ' VAL . 24.7 mt -70.58 -43.31 69.66 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . 0.408 ' N ' HE22 ' B' ' 53' ' ' GLN . 37.3 mt-30 -63.69 -21.13 66.23 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 122.158 0.98 . . . . 0.0 109.051 178.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -84.15 -50.59 7.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.159 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.733 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.4 mt -78.62 -46.68 18.71 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -176.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.693 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.2 mt -49.86 -60.07 5.74 Favored Pre-proline 0 N--CA 1.468 0.443 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -176.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.87 -13.88 37.46 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.17 1.913 . . . . 0.0 113.828 -178.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 18.9 mtmm -87.78 -6.34 58.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.433 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 . . . . . 0 C--N 1.327 -0.379 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.802 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.946 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.8 tt0 . . . . . 0 CA--C 1.508 -0.657 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.457 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -132.24 93.09 3.2 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.508 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.9 p-10 -138.42 -45.34 0.5 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.618 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -74.12 13.37 0.56 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.723 0.773 . . . . 0.0 110.645 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 1.028 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.52 123.93 17.89 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.547 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.773 -179.332 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 80.2 t . . . . . 0 CA--C 1.518 -0.252 0 CA-C-O 121.053 0.454 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.474 ' HB2' HD21 ' B' ' 95' ' ' LEU . 48.5 mt -94.94 -29.06 14.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.393 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.41 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.7 tp -142.61 138.32 30.66 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.8 mt -121.57 121.59 64.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.1 t -112.06 149.21 14.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.819 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.551 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.71 178.16 4.56 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.977 -179.63 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.525 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 12.7 mtpt 17.94 74.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 O-C-N 125.344 1.653 . . . . 0.0 113.727 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 13' ' ' LYS . 50.2 t -119.28 121.61 66.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.773 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.624 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 95.6 mtt180 -89.26 135.73 33.42 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.193 0.521 . . . . 0.0 111.464 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -130.57 106.53 8.56 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.627 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.5 OUTLIER 63.49 49.97 2.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.033 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.7 OUTLIER 70.7 25.6 4.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.205 178.754 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.522 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.8 tt0 -134.96 119.5 18.07 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.089 -0.244 . . . . 0.0 111.212 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.64 153.31 43.62 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.47 -157.95 19.51 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.314 -0.469 . . . . 0.0 112.474 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -129.33 132.18 47.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.833 0.349 . . . . 0.0 110.334 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.901 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -97.43 130.95 44.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.029 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -124.05 128.43 49.33 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.872 HD11 HG13 ' B' ' 92' ' ' VAL . 22.2 mt -108.47 118.01 35.67 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -98.65 165.22 11.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.026 179.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.8 -50.65 44.11 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.309 -0.86 . . . . 0.0 113.226 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -104.49 -3.75 23.57 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 167.2 30.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 119.421 -0.912 . . . . 0.0 112.704 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.805 HD12 HD11 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -115.9 125.66 73.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.664 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -129.92 119.02 22.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.236 0.541 . . . . 0.0 111.424 -178.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.901 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.8 t90 -112.05 133.82 53.98 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.002 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.483 ' HB2' ' CD2' ' B' ' 41' ' ' PHE . . . -115.67 135.28 22.64 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.231 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.828 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -74.1 150.84 43.52 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.576 2.184 . . . . 0.0 111.617 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -61.32 133.22 55.62 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.182 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.91 8.92 86.06 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.805 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.828 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.37 146.58 39.23 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.45 -0.441 . . . . 0.0 110.505 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . 0.465 ' OD2' ' HD2' ' B' ' 40' ' ' ARG . 2.4 p-10 -94.99 0.39 54.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.473 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.465 ' HD2' ' OD2' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -136.39 151.65 49.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.104 0.478 . . . . 0.0 111.785 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.483 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 35.5 m-85 -82.24 121.77 27.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.393 -0.821 . . . . 0.0 108.94 178.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.2 p -86.5 -19.8 28.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.162 0.506 . . . . 0.0 110.3 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.789 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 49.5 mm -108.63 110.68 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.803 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 7.5 t -137.69 101.6 4.51 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -129.13 144.24 51.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.045 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.468 ' O ' HG12 ' B' ' 50' ' ' ILE . 76.6 mmm -88.58 143.94 26.63 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.711 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -61.82 -18.97 61.95 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.89 -15.02 60.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.506 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.603 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.69 -6.02 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 109.983 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.663 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.9 mm -90.42 129.23 41.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.471 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 11.2 ttpt -86.32 -33.44 20.6 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.24 0.543 . . . . 0.0 109.825 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.527 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 27.5 p -178.38 -178.16 0.6 Allowed 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.089 -0.96 . . . . 0.0 108.638 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . 0.443 ' OE1' HD12 ' B' ' 100' ' ' LEU . 5.4 pm0 -134.89 140.94 46.18 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.996 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.091 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 47.1 mttp -102.2 145.29 29.62 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.528 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -124.15 129.39 74.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.099 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 176.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.494 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -90.17 117.52 68.12 Favored Pre-proline 0 C--O 1.251 1.138 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.59 173.03 10.49 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 125.165 3.91 . . . . 0.0 114.441 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.7 mp0 -61.12 160.48 10.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.069 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.76 -28.94 8.13 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.946 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.8 mttp -87.79 152.8 21.84 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.65 -20.34 66.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.228 0.537 . . . . 0.0 110.322 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.735 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.1 OUTLIER -135.48 144.0 46.15 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.923 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.658 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -85.44 142.36 13.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.54 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 21.0 mt-30 -141.01 163.51 32.78 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.421 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -141.96 153.46 44.34 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.039 -1.437 . . . . 0.0 108.04 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.091 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.71 146.03 30.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 119.045 0.839 . . . . 0.0 110.678 178.18 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.805 HD11 HD12 ' B' ' 31' ' ' ILE . 55.7 mt -97.19 106.65 19.01 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.149 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.592 ' HA ' HG22 ' B' ' 74' ' ' THR . 14.1 t -91.72 124.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.45 HD22 HD13 ' B' ' 50' ' ' ILE . 5.5 mt -108.08 153.91 22.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.022 0.439 . . . . 0.0 112.151 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.603 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -76.06 -5.48 46.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.768 0.794 . . . . 0.0 108.977 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.2 -4.64 48.67 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.6 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.26 20.68 51.77 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.465 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . 0.447 ' HB3' HD12 ' B' ' 69' ' ' LEU . 23.5 t70 -126.2 160.47 30.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.561 -0.32 . . . . 0.0 110.509 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.592 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.8 p -141.65 131.22 23.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.048 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.577 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 10.5 m -110.21 104.17 12.96 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.106 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.4 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 7.5 m-20 -82.26 153.58 25.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.235 0.54 . . . . 0.0 112.206 -178.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.789 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 64.5 m-85 -140.02 111.31 7.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.857 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.624 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.78 112.01 21.29 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.731 ' HE2' ' HB3' ' B' ' 88' ' ' GLU . 20.6 m-85 -76.91 92.52 3.66 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.2 9.16 34.88 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.525 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 52.2 t30 -84.76 92.75 8.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.03 0.443 . . . . 0.0 110.238 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -49.85 -32.0 13.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.678 -178.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.99 -60.63 3.02 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -178.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.481 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.7 p -128.27 14.19 6.67 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.707 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.96 -46.02 10.85 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.412 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.56 -54.52 33.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.481 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -64.66 -37.64 88.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.229 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.731 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 14.2 mt-10 -65.5 -45.17 84.61 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.278 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.658 ' HD3' HG23 ' B' ' 63' ' ' ILE . 19.2 ttp180 -54.99 -47.02 75.18 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.03 -44.96 95.59 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 113.536 -1.665 . . . . 0.0 112.568 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.93 -42.09 81.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 117.841 0.291 . . . . 0.0 111.073 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.872 HG13 HD11 ' B' ' 26' ' ' LEU . 34.0 t -62.41 -42.21 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.17 -56.2 25.18 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.579 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.09 -52.59 63.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.087 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.724 ' HG ' HD12 ' B' ' 99' ' ' LEU . 15.1 tp -61.96 -42.54 99.24 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.038 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.491 HD12 HG12 ' B' ' 92' ' ' VAL . 19.1 mt -68.23 -43.47 77.88 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.73 -21.31 65.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.361 1.077 . . . . 0.0 109.347 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.42 -50.93 6.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.164 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.724 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.8 mt -74.28 -50.88 17.08 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 113.452 -1.704 . . . . 0.0 114.675 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.711 HD23 ' HB3' ' B' ' 47' ' ' TYR . 40.5 mt -49.87 -57.53 12.12 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.613 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 62.2 Cg_exo -54.84 -16.92 12.51 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.614 2.209 . . . . 0.0 114.076 -179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -87.52 -13.65 42.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.754 0.312 . . . . 0.0 110.945 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.793 -179.091 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.921 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.1 tt0 . . . . . 0 CA--C 1.515 -0.389 0 CA-C-O 120.89 0.376 . . . . 0.0 110.463 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.509 ' HB2' ' CD2' ' A' ' 403' ' ' PHE . 9.4 p-10 -135.64 92.1 2.79 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.351 0.596 . . . . 0.0 112.241 -177.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.518 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.3 p-10 -139.48 -46.99 0.46 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -73.14 11.56 0.7 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.786 0.803 . . . . 0.0 110.44 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.888 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -55.49 116.14 2.71 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.39 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.572 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 95.5 t . . . . . 0 CA--C 1.519 -0.247 0 CA-C-O 121.048 0.451 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.426 ' HB2' HD21 ' B' ' 95' ' ' LEU . 25.7 mt -97.53 -29.75 13.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.841 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.0 tp -139.5 140.4 37.2 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 79.4 mt -122.59 121.94 64.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.775 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.3 t -111.96 148.21 15.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.929 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.597 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.03 175.68 5.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.556 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.1 79.68 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 O-C-N 125.393 1.683 . . . . 0.0 113.61 -179.62 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.597 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.6 t -130.74 126.98 61.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 114.878 -1.056 . . . . 0.0 108.957 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.591 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 9.2 mtm180 -95.16 144.87 25.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.608 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.8 110.33 6.68 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 13.0 tppt? 67.82 52.19 0.74 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.627 0.727 . . . . 0.0 110.003 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 62.89 25.28 14.99 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.869 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.555 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.6 pt20 -138.32 131.72 30.49 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.98 -0.45 . . . . 0.0 110.263 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.418 ' HA ' ' HA ' ' B' ' 16' ' ' ARG . 2.1 t70 -82.72 153.52 25.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -177.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.11 -154.77 12.42 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.914 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 136.65 50.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.085 0.469 . . . . 0.0 110.077 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.941 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.44 141.79 30.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.938 -178.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 40.2 m-85 -133.19 122.54 24.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.857 HD11 HG13 ' B' ' 92' ' ' VAL . 19.6 mt -104.34 120.67 41.71 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.8 -178.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -100.99 161.61 13.47 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.19 -20.41 65.39 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -107.78 -20.2 13.29 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -161.9 167.67 24.28 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.824 -176.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.855 HD13 HD11 ' B' ' 67' ' ' LEU . 1.1 tt -109.65 117.71 55.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -119.05 152.65 36.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.969 0.414 . . . . 0.0 110.752 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.941 ' HB2' HD12 ' B' ' 24' ' ' LEU . 38.3 t90 -147.32 140.78 25.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.408 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -125.51 138.16 31.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.944 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' B' ' 34' ' ' ALA . 12.5 Cg_exo -68.33 153.6 73.89 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.644 2.229 . . . . 0.0 111.374 179.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -65.23 116.01 6.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.964 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.96 4.1 54.48 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.432 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.549 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -97.36 143.22 28.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.582 0.706 . . . . 0.0 111.253 179.762 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.63 -14.29 52.28 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.494 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.42 156.81 45.23 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.939 0.399 . . . . 0.0 111.463 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -75.69 131.49 39.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.187 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -92.61 -28.93 16.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.442 0.639 . . . . 0.0 109.752 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.784 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 16.7 mm -97.57 123.84 50.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.404 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 31.2 t -147.99 101.45 3.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.486 ' CD2' HG23 ' B' ' 43' ' ' ILE . 85.0 m-70 -124.61 128.74 49.35 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.67 0.272 . . . . 0.0 110.816 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.529 ' O ' HG12 ' B' ' 50' ' ' ILE . 0.0 OUTLIER -78.96 139.72 38.17 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.565 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -58.84 -24.32 61.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.65 -8.74 57.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.57 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.71 ' HA ' ' HE2' ' B' ' 70' ' ' HIS . 0.9 OUTLIER -111.63 -10.14 14.12 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.282 0.563 . . . . 0.0 110.289 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.652 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.1 mm -91.94 130.2 41.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.434 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 11.1 tttp -89.78 -46.25 8.72 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.435 0.636 . . . . 0.0 110.08 -179.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.541 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -155.95 -177.88 6.9 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.679 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . 0.409 ' HG2' ' HB3' ' B' ' 96' ' ' LEU . 1.5 pp0? -146.48 143.11 28.74 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.713 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.097 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 46.2 mttp -108.76 156.62 19.41 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.985 0.421 . . . . 0.0 110.123 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.533 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.9 OUTLIER -132.11 130.04 60.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 176.27 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.512 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.36 117.81 68.54 Favored Pre-proline 0 C--O 1.25 1.121 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.19 173.45 12.21 Favored 'Trans proline' 0 C--N 1.344 0.298 1 C-N-CA 125.357 4.038 . . . . 0.0 114.544 -177.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.68 160.56 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.09 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.85 -29.27 7.89 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.921 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.9 mttp -91.34 150.58 21.23 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.28 -4.24 21.03 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.134 0.492 . . . . 0.0 110.742 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.411 ' CE ' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -141.81 143.94 33.68 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.756 -179.397 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.644 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -90.55 136.62 23.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.512 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 13.8 mt-30 -138.17 163.35 31.9 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -141.09 154.03 45.74 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.184 -1.371 . . . . 0.0 107.964 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.097 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.71 143.67 28.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 118.927 0.785 . . . . 0.0 111.21 178.368 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.855 HD11 HD13 ' B' ' 31' ' ' ILE . 77.4 mt -96.02 109.77 22.12 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.138 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.583 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.7 t -95.41 108.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.499 HD22 HD13 ' B' ' 50' ' ' ILE . 4.1 mt -92.06 156.17 17.58 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.045 0.45 . . . . 0.0 112.008 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.71 ' HE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -80.18 1.13 29.44 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.347 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.49 -7.61 59.63 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.251 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.0 17.56 47.03 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.745 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.22 159.37 33.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.7 0.286 . . . . 0.0 110.711 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.583 HG22 ' HA ' ' B' ' 68' ' ' VAL . 20.8 p -135.35 130.86 35.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.885 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.536 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.18 102.42 11.56 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.367 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -82.22 142.72 31.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.465 0.65 . . . . 0.0 111.742 -178.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.784 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 52.2 m-85 -126.79 115.25 19.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.206 179.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.591 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.0 t60 -87.2 110.64 20.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.866 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.767 ' HE2' ' HB3' ' B' ' 88' ' ' GLU . 26.8 m-85 -81.56 93.23 6.66 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.1 4.02 52.86 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.556 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -81.79 91.27 6.47 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 121.212 0.53 . . . . 0.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.7 -39.95 5.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.423 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -59.64 4.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.472 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.1 p -127.61 10.43 6.64 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.47 -46.86 9.88 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.402 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.99 -53.88 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.84 0.352 . . . . 0.0 110.772 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 3.8 mttt -65.49 -35.89 82.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.057 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.767 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.5 mt-10 -65.37 -47.26 77.0 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.644 ' HD3' HG23 ' B' ' 63' ' ' ILE . 22.3 ttp180 -54.43 -47.57 72.66 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.015 0.912 . . . . 0.0 108.596 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.39 -45.73 91.8 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.662 -1.608 . . . . 0.0 112.357 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.14 -40.71 90.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.909 0.322 . . . . 0.0 110.998 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.857 HG13 HD11 ' B' ' 26' ' ' LEU . 40.9 t -62.92 -43.45 98.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 177.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.76 -55.38 35.88 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.588 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -53.46 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.463 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.868 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.7 tp -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.272 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.435 HD12 HG12 ' B' ' 92' ' ' VAL . 30.9 mt -71.01 -47.75 57.03 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 117.663 0.21 . . . . 0.0 110.981 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.41 -17.83 63.08 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.76 0.791 . . . . 0.0 109.757 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -88.3 -48.45 7.66 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.863 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.868 HD12 ' HG ' ' B' ' 95' ' ' LEU . 9.9 mt -79.29 -47.46 15.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.087 -1.415 . . . . 0.0 114.538 -177.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.652 HD22 ' HB ' ' B' ' 50' ' ' ILE . 26.5 mt -49.81 -53.88 37.74 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 17.4 Cg_endo -57.45 -18.52 31.94 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.332 2.021 . . . . 0.0 113.4 -179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -87.58 -8.52 56.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.715 0.293 . . . . 0.0 111.292 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.328 -179.883 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.627 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.508 -0.671 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.435 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 3.9 m-20 -139.83 87.48 2.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.52 ' C ' ' H ' ' A' ' 403' ' ' PHE . 1.3 p30 -138.45 -48.62 0.53 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -67.98 6.89 0.62 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.636 0.732 . . . . 0.0 110.637 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.949 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.56 120.3 7.52 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.766 179.107 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.78 -178.677 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.3 t . . . . . 0 CA--C 1.514 -0.425 0 CA-C-O 121.199 0.523 . . . . 0.0 111.126 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 34.7 mt -91.37 -33.3 15.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.181 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tp -131.21 127.48 37.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.992 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 71.1 mt -110.21 124.25 66.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.863 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.4 t -115.65 150.24 17.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.331 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.613 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -115.47 178.0 4.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.3 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.589 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.44 70.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 O-C-N 125.294 1.621 . . . . 0.0 113.245 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.613 HG23 ' O ' ' B' ' 13' ' ' LYS . 19.7 t -119.1 131.26 72.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.022 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.707 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 98.9 mtt180 -101.96 139.2 37.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.316 0.579 . . . . 0.0 111.301 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.568 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -134.84 109.57 8.61 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.968 -1.014 . . . . 0.0 108.728 179.039 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.95 41.43 6.58 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.477 0.485 . . . . 0.0 110.914 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.1 tptp 73.95 27.3 1.65 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.548 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.707 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 35.8 mt-30 -125.82 124.24 40.49 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -85.78 139.36 31.38 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.013 0.196 . . . . 0.0 110.798 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.575 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -172.96 -153.71 9.74 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.51 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.29 137.85 52.93 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.948 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.61 142.28 33.21 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.736 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -136.44 120.68 17.9 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.875 HD11 HG13 ' B' ' 92' ' ' VAL . 15.2 mt -100.27 120.66 40.26 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.636 -0.425 . . . . 0.0 111.28 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.6 mpt? -96.51 166.91 11.46 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.12 66.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -116.62 -0.89 12.28 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . 0.463 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 16.8 ptt180 -157.13 158.69 36.81 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 119.158 -1.017 . . . . 0.0 112.699 -177.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 1.003 HD13 HD11 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -110.39 121.62 63.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.73 178.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.85 150.43 42.88 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.038 0.447 . . . . 0.0 110.662 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.948 ' HB2' HD12 ' B' ' 24' ' ' LEU . 31.1 t90 -146.99 139.83 25.1 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -131.1 137.52 30.88 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.575 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 22.1 Cg_exo -64.52 160.93 37.27 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.515 2.143 . . . . 0.0 111.515 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.44 131.26 50.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.191 0.519 . . . . 0.0 111.358 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.01 29.85 68.51 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.078 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 21.8 mmtm -113.7 147.55 37.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 117.023 0.412 . . . . 0.0 110.46 179.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -96.32 -14.65 22.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.044 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -124.02 146.7 48.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.45 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.421 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 45.4 m-85 -83.57 121.83 27.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.818 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . 0.4 ' OG1' ' HD3' ' B' ' 35' ' ' PRO . 1.1 p -83.81 -21.13 32.2 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.262 0.553 . . . . 0.0 110.411 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.789 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 10.3 mm -106.28 124.39 61.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.56 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 42.3 t -147.78 101.45 3.32 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.827 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.516 ' CD2' HG23 ' B' ' 43' ' ' ILE . 73.4 m-70 -129.94 139.13 51.15 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.52 ' O ' HG12 ' B' ' 50' ' ' ILE . 79.6 mmm -92.4 142.77 27.06 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.698 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.7 m-85 -59.18 -21.3 59.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.25 0.548 . . . . 0.0 109.817 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . 0.594 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -68.38 -22.75 64.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.144 -0.935 . . . . 0.0 112.185 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.557 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -102.54 -10.92 18.91 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.999 0.428 . . . . 0.0 110.771 -179.426 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.678 ' HB ' HD22 ' B' ' 100' ' ' LEU . 0.9 OUTLIER -86.35 132.45 32.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.678 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -92.72 -55.34 3.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.609 0.719 . . . . 0.0 109.964 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.497 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -144.52 -177.45 5.5 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . 0.648 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 6.3 pt20 -141.87 145.85 35.1 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.694 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.069 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 49.3 mttp -107.16 147.05 30.59 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 177.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.732 ' HB ' ' HD3' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.92 123.46 62.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 176.365 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -88.97 120.27 69.94 Favored Pre-proline 0 C--O 1.245 0.868 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -69.53 172.69 11.96 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 124.415 3.41 . . . . 0.0 113.968 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.46 161.29 12.04 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.203 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.85 -28.96 7.75 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.627 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 6.4 mttp -85.24 161.36 19.6 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 175.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.02 -16.75 64.18 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.357 0.599 . . . . 0.0 110.496 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.52 ' HE2' ' HG3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -140.05 150.37 44.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.415 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.603 ' O ' ' HB2' ' B' ' 79' ' ' PHE . 4.1 mp -89.11 135.09 26.73 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.41 HE21 ' HB2' ' B' ' 64' ' ' GLN . 7.0 mt-30 -134.35 162.95 30.79 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -175.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.756 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -140.0 153.62 46.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.968 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.069 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.45 145.51 30.24 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 119.232 0.924 . . . . 0.0 110.72 178.26 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 1.003 HD11 HD13 ' B' ' 31' ' ' ILE . 95.6 mt -94.74 109.08 21.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.421 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.536 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.0 t -95.36 108.72 21.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.53 HD22 HD13 ' B' ' 50' ' ' ILE . 5.2 mt -88.77 155.83 19.33 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.102 -177.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.557 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -79.23 -1.58 37.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.666 0.746 . . . . 0.0 109.034 178.294 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -5.91 58.71 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.584 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.5 20.45 44.65 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.556 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . 0.525 ' HB3' HD12 ' B' ' 69' ' ' LEU . 19.1 t70 -126.14 160.86 29.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.62 -0.29 . . . . 0.0 110.279 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.536 HG22 ' HA ' ' B' ' 68' ' ' VAL . 17.5 p -138.23 131.21 29.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.459 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.535 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.8 m -110.46 102.77 11.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.434 HD22 ' CG ' ' A' ' 400' ' ' ASP . 3.2 m-20 -82.99 144.63 29.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.552 0.691 . . . . 0.0 112.303 -177.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.789 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 46.5 m-85 -129.59 107.32 9.36 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.564 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.575 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.98 112.43 21.82 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.639 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.756 ' HE1' ' HB2' ' B' ' 65' ' ' LEU . 81.3 m-85 -83.56 95.98 8.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.92 5.47 51.56 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.589 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.4 t-20 -87.23 91.45 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.915 0.388 . . . . 0.0 110.015 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.06 -39.28 9.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.923 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.91 -59.44 4.33 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.53 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.61 10.41 6.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -44.99 -48.5 11.47 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.506 HG22 HG12 ' B' ' 63' ' ' ILE . 4.8 t -57.63 -52.14 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.15 0.5 . . . . 0.0 110.685 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.6 mttt -68.72 -33.63 74.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.61 ' HB3' ' CE2' ' B' ' 79' ' ' PHE . 11.3 mt-10 -65.79 -43.53 88.49 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.732 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 6.1 ttm105 -57.73 -43.71 85.51 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 177.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.22 -44.76 87.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.289 -1.323 . . . . 0.0 112.758 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.06 -45.11 74.77 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 117.784 0.266 . . . . 0.0 111.451 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.875 HG13 HD11 ' B' ' 26' ' ' LEU . 44.4 t -60.69 -43.19 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.648 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.4 ttpm? -59.27 -55.01 40.33 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.821 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -53.84 -54.33 39.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.474 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.637 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.2 tp -61.76 -41.71 98.05 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.349 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.488 HD12 HG12 ' B' ' 92' ' ' VAL . 22.1 mt -69.29 -44.62 71.42 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 117.876 0.307 . . . . 0.0 110.221 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . 0.511 ' N ' HE22 ' B' ' 53' ' ' GLN . 5.8 tp-100 -62.0 -24.28 66.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.233 1.016 . . . . 0.0 109.079 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.464 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 2.0 mm-40 -84.97 -44.76 12.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.299 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.67 HD13 ' CE2' ' B' ' 47' ' ' TYR . 20.4 mt -81.06 -47.07 14.05 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.698 HD23 ' HB3' ' B' ' 47' ' ' TYR . 34.6 mt -50.15 -56.77 15.64 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -176.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 52.4 Cg_exo -57.09 -22.32 46.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.407 2.071 . . . . 0.0 114.094 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.464 ' HD3' ' O ' ' B' ' 98' ' ' GLN . 12.2 mtpt -88.53 -10.93 47.2 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.594 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 71.4 m-85 . . . . . 0 C--N 1.329 -0.29 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.677 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.918 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.51 -0.582 0 CA-C-O 120.513 0.197 . . . . 0.0 111.316 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 177.7 77.12 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.052 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.555 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.04 -54.2 0.58 Allowed 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -177.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . 0.416 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 3.9 p30 -69.9 11.5 0.29 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.728 0.775 . . . . 0.0 110.555 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 1.013 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.53 126.28 25.85 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.858 179.352 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.714 -178.865 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' B' ' 27' ' ' MET . 49.0 t . . . . . 0 N--CA 1.45 -0.442 0 CA-C-O 121.08 0.466 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.1 mt -97.37 -30.39 12.96 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.476 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 8.5 tp -131.76 127.31 36.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.837 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 75.8 mt -111.78 121.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.825 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -111.21 149.9 13.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.215 -179.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.586 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.65 176.94 4.86 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.841 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.546 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.0 mtpm? 18.17 72.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 O-C-N 125.352 1.657 . . . . 0.0 113.527 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.586 HG23 ' O ' ' B' ' 13' ' ' LYS . 18.6 t -119.83 124.52 72.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.577 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.581 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 4.8 mtp180 -89.19 120.21 30.37 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.179 0.514 . . . . 0.0 111.252 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.631 ' HG2' HG13 ' B' ' 43' ' ' ILE . 28.1 tp60 -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.21 37.57 2.08 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.24 23.81 7.68 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.336 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.539 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.2 tt0 -126.21 120.77 30.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.326 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.57 153.29 43.03 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.758 0.313 . . . . 0.0 111.808 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.43 ' HA2' ' N ' ' B' ' 36' ' ' GLU . . . 178.08 -154.9 15.83 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.783 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.98 132.87 49.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.997 0.427 . . . . 0.0 110.387 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -99.01 143.13 29.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.54 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -134.28 124.42 25.85 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.951 HD11 HG13 ' B' ' 92' ' ' VAL . 17.3 mt -105.13 110.17 22.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.349 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . 0.424 ' HA ' ' HA ' ' B' ' 8' ' ' VAL . 2.2 mpt? -89.46 162.58 15.66 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.47 -23.64 62.9 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -116.23 -12.56 11.16 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -159.57 166.64 30.34 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 119.703 -0.799 . . . . 0.0 112.73 -176.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 1.031 HD13 HD11 ' B' ' 67' ' ' LEU . 1.1 tt -112.21 119.41 60.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.835 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -120.16 151.89 38.44 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.328 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.889 ' HB2' HD12 ' B' ' 24' ' ' LEU . 27.1 t90 -146.9 139.77 25.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -124.76 143.87 44.94 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.274 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.537 ' O ' ' HB2' ' B' ' 38' ' ' LYS . 28.3 Cg_exo -61.85 159.95 31.28 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.476 2.118 . . . . 0.0 111.662 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.43 ' N ' ' HA2' ' B' ' 22' ' ' GLY . 5.3 tp10 -57.34 130.52 46.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.21 0.529 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.0 29.81 75.75 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.031 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.15 151.28 31.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.056 0.428 . . . . 0.0 110.843 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -98.65 -22.08 16.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.013 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.405 ' H ' ' HG2' ' B' ' 40' ' ' ARG . 6.5 ptp180 -108.67 140.92 41.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.651 -178.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -84.74 124.59 31.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.011 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.4 p -92.58 -13.65 29.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.281 0.562 . . . . 0.0 110.594 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.739 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -114.09 124.89 71.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.135 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.0 t -147.81 102.84 3.45 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -124.5 137.41 54.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.488 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.7 mmm -89.16 138.89 31.02 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.694 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.7 m-85 -56.97 -24.39 52.82 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.301 0.572 . . . . 0.0 110.358 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.27 -32.65 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.614 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.571 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -91.58 -11.87 36.0 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 123.538 0.524 . . . . 0.0 111.604 -178.272 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.626 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.5 mm -83.57 135.69 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.413 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 18.0 ttpp -87.18 -47.69 8.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 4.7 p -167.73 -177.77 3.6 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.318 -1.31 . . . . 0.0 108.273 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -135.05 144.04 47.05 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.616 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.013 ' HD3' ' HB3' ' A' ' 403' ' ' PHE . 48.1 mttp -102.16 148.31 25.56 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.535 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -125.78 127.84 71.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 176.542 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.434 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.9 p -91.3 115.62 64.78 Favored Pre-proline 0 C--O 1.25 1.111 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 59.7 Cg_endo -67.6 173.14 9.36 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 125.125 3.883 . . . . 0.0 114.042 -177.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -59.28 160.05 7.01 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.123 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.52 -29.05 8.13 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.534 -1.427 . . . . 0.0 109.534 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.596 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 5.1 mttm -86.9 153.18 21.81 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.37 -16.21 64.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.242 0.544 . . . . 0.0 110.493 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.918 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.31 138.38 38.31 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.926 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.63 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -80.34 131.61 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.54 162.91 30.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -176.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.689 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -140.38 153.89 46.52 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.068 -1.424 . . . . 0.0 107.719 177.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.005 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -145.7 142.43 28.98 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.973 0.806 . . . . 0.0 110.483 178.176 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 1.031 HD11 HD13 ' B' ' 31' ' ' ILE . 39.8 mt -94.0 106.94 18.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.024 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.511 ' HA ' HG22 ' B' ' 74' ' ' THR . 8.1 t -94.24 113.84 29.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.042 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.542 HD22 HD13 ' B' ' 50' ' ' ILE . 3.2 mt -98.36 158.9 15.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.021 0.439 . . . . 0.0 112.066 -177.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.571 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -81.18 0.02 38.38 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.297 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.67 -3.47 56.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.531 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.91 19.96 56.68 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . 0.42 ' HB3' HD12 ' B' ' 69' ' ' LEU . 18.9 t70 -126.04 157.41 38.01 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.559 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 20.3 p -137.15 130.86 31.74 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.524 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 0.8 OUTLIER -107.96 105.34 15.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.157 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -86.36 128.46 34.94 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 112.534 -177.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.739 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 50.3 m-85 -114.32 110.03 19.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.397 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.581 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.5 t-160 -86.82 113.35 22.56 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.026 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.689 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 46.0 m-85 -80.18 92.33 5.68 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.31 27.66 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.926 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.546 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -107.14 91.33 3.61 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -35.51 4.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.19 -0.914 . . . . 0.0 113.337 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 57.1 m -58.88 -59.99 4.57 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.516 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.8 p -127.9 9.99 6.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.596 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -42.8 -50.15 5.68 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 113.863 1.061 . . . . 0.0 113.863 -177.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.462 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.92 -52.79 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.909 0.385 . . . . 0.0 110.992 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.516 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -66.73 -35.49 80.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.138 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.643 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.3 mt-10 -64.97 -45.46 85.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.63 ' HD3' HG23 ' B' ' 63' ' ' ILE . 20.6 ttp180 -55.22 -47.51 75.24 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.5 -45.27 93.77 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.799 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.7 -42.44 82.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 117.843 0.292 . . . . 0.0 111.26 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.951 HG13 HD11 ' B' ' 26' ' ' LEU . 45.8 t -62.36 -42.26 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -53.46 58.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.69 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . 0.419 ' HA ' ' HG2' ' B' ' 97' ' ' GLN . 2.9 m-20 -57.82 -54.65 44.46 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.045 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.824 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -60.67 -40.33 91.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.137 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.493 HD12 HG12 ' B' ' 92' ' ' VAL . 22.7 mt -69.72 -45.86 67.24 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.729 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . 0.419 ' HG2' ' HA ' ' B' ' 94' ' ' ASP . 19.4 pt20 -65.03 -18.39 65.26 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.745 0.783 . . . . 0.0 109.544 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.448 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 33.4 mm-40 -84.79 -50.86 7.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.981 178.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.824 HD12 ' HG ' ' B' ' 95' ' ' LEU . 9.3 mt -78.41 -45.91 21.18 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.694 HD23 ' HB3' ' B' ' 47' ' ' TYR . 32.7 mt -51.58 -51.23 71.58 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -176.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 45.4 Cg_endo -67.36 -24.96 42.57 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.198 1.932 . . . . 0.0 114.341 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 32.3 mttm -63.82 -31.67 72.93 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.003 0.43 . . . . 0.0 111.804 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 . . . . . 0 C--N 1.322 -0.621 0 CA-C-O 121.665 0.745 . . . . 0.0 110.485 -179.146 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.45 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 5.3 pt-20 . . . . . 0 C--O 1.222 -0.368 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.492 ' HB3' ' HE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.5 87.19 2.24 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.17 -176.799 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.526 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -138.75 -50.31 0.54 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.287 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.33 13.63 0.42 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.546 0.688 . . . . 0.0 110.264 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.92 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.62 127.51 31.74 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.144 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 . . . . . 0 C--N 1.317 -0.839 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.896 -178.566 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.6 t . . . . . 0 CA--C 1.515 -0.384 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.443 ' HB2' HD21 ' B' ' 95' ' ' LEU . 19.5 mt -88.28 -28.85 20.82 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.486 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.411 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -135.61 136.85 41.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.9 mt -121.66 120.14 60.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.797 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.5 t -110.89 150.02 13.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.463 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.548 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.1 mtmp? -116.4 175.89 5.35 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.406 -178.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.48 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.3 OUTLIER 17.87 70.9 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.679 0 O-C-N 125.346 1.654 . . . . 0.0 113.293 -178.527 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.548 HG23 ' O ' ' B' ' 13' ' ' LYS . 11.7 t -114.92 121.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.073 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.575 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 73.4 mtp85 -92.49 120.92 33.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.414 HE21 ' HB3' ' B' ' 17' ' ' GLN . 0.6 OUTLIER -113.27 103.37 11.25 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 178.311 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 57.5 mttp 63.76 56.44 1.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.076 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 68.51 21.23 8.19 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.765 177.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tt0 -133.7 122.6 23.61 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.831 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.03 153.44 43.2 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.92 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.668 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 177.98 -170.75 43.13 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 116.148 -0.478 . . . . 0.0 112.706 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 131.74 54.04 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.938 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.31 139.1 33.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.542 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . 0.457 ' CD2' ' HE1' ' B' ' 41' ' ' PHE . 71.3 m-85 -132.7 122.75 25.08 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.908 HD11 HG13 ' B' ' 92' ' ' VAL . 14.0 mt -102.11 116.43 32.66 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.458 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -93.99 162.45 13.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.44 -8.76 6.66 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -127.9 -16.13 4.7 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -158.24 160.5 37.19 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.439 -176.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 1.018 HD13 HD11 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.37 118.66 53.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.416 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -119.14 154.17 33.69 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.415 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.938 ' HB2' HD12 ' B' ' 24' ' ' LEU . 55.2 t90 -146.87 129.42 15.96 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.401 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -109.96 121.82 40.77 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.312 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.445 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 40.3 Cg_endo -69.03 139.46 42.82 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.469 2.112 . . . . 0.0 111.833 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.668 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.0 mt-10 -57.92 132.04 52.22 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.628 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.09 -7.48 64.53 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.141 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -113.37 152.94 29.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.583 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -97.55 -7.32 31.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.36 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -124.24 152.02 43.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.109 0.48 . . . . 0.0 111.938 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.457 ' HE1' ' CD2' ' B' ' 25' ' ' TYR . 44.8 m-85 -81.16 121.81 26.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.901 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 12.7 p -91.46 -9.85 43.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 110.111 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.79 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 19.0 mm -117.34 119.99 63.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.159 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 27.7 t -148.04 101.43 3.29 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.482 ' CD2' HG23 ' B' ' 43' ' ' ILE . 66.0 m-70 -125.99 132.95 51.93 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.49 ' O ' HG12 ' B' ' 50' ' ' ILE . 50.9 mtp -86.6 143.38 27.68 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.676 ' HB3' HD23 ' B' ' 100' ' ' LEU . 19.9 m-85 -59.92 -22.09 61.97 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.195 0.521 . . . . 0.0 109.959 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.86 -3.31 31.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.707 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.559 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 12.4 m-20 -118.78 -9.99 10.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.252 0.549 . . . . 0.0 110.105 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.804 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.3 mm -92.39 127.7 44.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.485 ' HB2' ' HB3' ' B' ' 70' ' ' HIS . 29.1 tttp -87.15 -49.49 7.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.477 0.656 . . . . 0.0 110.069 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.08 -177.43 5.91 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.188 -178.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . 0.43 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 24.3 pt20 -144.49 146.78 32.6 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.969 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.086 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 39.3 mttp -109.06 146.18 34.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 177.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.536 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -125.11 128.54 73.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 176.211 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -90.87 118.66 68.77 Favored Pre-proline 0 C--O 1.25 1.105 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -178.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.55 173.03 13.14 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 125.196 3.931 . . . . 0.0 114.017 -177.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -61.35 160.24 11.12 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.79 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.84 -28.97 8.09 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -177.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 3.6 mttm -87.41 164.78 16.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.44 -14.96 57.86 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.314 0.578 . . . . 0.0 109.924 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.462 ' HZ1' ' HB2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -133.46 129.79 37.72 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.445 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.442 HG21 ' HA ' ' B' ' 86' ' ' VAL . 2.7 mp -77.98 129.6 37.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 177.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -135.67 163.63 29.71 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.701 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.8 tp -138.84 153.43 48.34 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 113.069 -1.878 . . . . 0.0 106.906 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.086 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.32 140.98 26.83 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 119.07 0.85 . . . . 0.0 110.33 178.336 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 1.018 HD11 HD13 ' B' ' 31' ' ' ILE . 94.3 mt -94.02 111.22 22.91 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.444 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.621 ' HA ' HG22 ' B' ' 74' ' ' THR . 15.0 t -95.73 102.83 14.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.719 HD22 HD13 ' B' ' 50' ' ' ILE . 1.3 mt -84.06 152.89 24.11 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.942 -176.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.559 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 1.6 p-80 -81.38 6.4 14.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.695 0.759 . . . . 0.0 109.004 178.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.82 -22.04 46.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.226 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.93 4.51 24.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.184 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . 0.522 ' OD2' HD12 ' B' ' 69' ' ' LEU . 4.5 p-10 -126.65 175.95 7.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.075 0.464 . . . . 0.0 111.807 -179.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.621 HG22 ' HA ' ' B' ' 68' ' ' VAL . 14.2 p -136.85 146.83 46.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -179.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.545 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 18.6 m -122.24 103.47 8.79 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.108 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.446 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 6.8 m-20 -81.98 150.86 27.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.265 0.555 . . . . 0.0 112.273 -178.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.79 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.5 m-85 -137.34 117.85 13.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.31 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.495 ' HB3' ' O ' ' B' ' 16' ' ' ARG . 4.5 t-160 -92.15 113.69 26.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.708 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.701 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 65.2 m-85 -83.7 93.16 7.86 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.71 3.48 53.84 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.48 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.9 t-20 -85.1 91.19 8.05 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.09 -41.9 2.76 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.427 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.35 -59.84 3.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 20.8 p -127.78 7.93 6.25 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -176.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.506 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -41.1 -52.89 3.17 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.442 ' HA ' HG21 ' B' ' 63' ' ' ILE . 2.2 t -57.67 -49.11 81.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.544 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 5.8 mptt -70.06 -31.95 69.82 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.636 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.2 mt-10 -65.92 -44.1 86.15 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.482 ' HD2' HD12 ' B' ' 55' ' ' ILE . 23.4 ttp180 -56.51 -47.56 79.05 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . 0.672 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -63.39 -44.69 93.98 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.38 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.13 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.884 0.311 . . . . 0.0 111.424 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.908 HG13 HD11 ' B' ' 26' ' ' LEU . 57.0 t -59.81 -45.11 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.672 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.6 tmmt? -58.55 -54.56 45.72 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.007 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.07 -54.43 30.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.101 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.872 ' HG ' HD12 ' B' ' 99' ' ' LEU . 14.8 tp -65.29 -30.6 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.025 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.449 HD12 HG12 ' B' ' 92' ' ' VAL . 24.0 mt -76.18 -42.58 45.91 Favored 'General case' 0 C--O 1.216 -0.676 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -60.81 -24.52 65.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.379 1.085 . . . . 0.0 108.745 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.98 -46.62 11.86 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.551 -1.659 . . . . 0.0 111.363 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.872 HD12 ' HG ' ' B' ' 95' ' ' LEU . 11.5 mt -86.78 -28.11 23.18 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -176.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.804 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.3 mt -67.57 -58.64 8.15 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.0 -21.67 72.81 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.888 1.725 . . . . 0.0 112.993 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.522 ' HG2' ' HA ' ' B' ' 99' ' ' LEU . 3.8 ptmm? -87.91 2.2 52.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.598 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.475 ' HD2' ' O ' ' B' ' 99' ' ' LEU . 11.2 m-85 . . . . . 0 N--CA 1.463 0.211 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.734 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 20.9 tt0 . . . . . 0 CA--C 1.518 -0.275 0 N-CA-C 111.259 0.096 . . . . 0.0 111.259 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.566 ' HB3' ' HE2' ' A' ' 403' ' ' PHE . 5.1 m-20 -150.35 82.58 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.6 p-10 -139.01 -42.31 0.47 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.18 15.83 0.15 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.72 0.771 . . . . 0.0 110.93 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 1.088 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -55.86 132.31 49.21 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.693 179.307 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 . . . . . 0 C--N 1.315 -0.908 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.369 -178.858 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 90.9 t . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.802 0.334 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.414 ' HB2' HD21 ' B' ' 95' ' ' LEU . 45.3 mt -94.73 -30.36 14.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.618 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.0 tp -136.64 135.11 38.01 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 77.8 mt -118.55 119.55 61.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.722 HG21 HD23 ' B' ' 24' ' ' LEU . 2.8 t -108.46 148.64 12.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.812 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.572 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.11 173.59 6.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.114 -178.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 17.75 68.24 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 O-C-N 125.163 1.539 . . . . 0.0 114.214 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.572 HG23 ' O ' ' B' ' 13' ' ' LYS . 24.4 t -117.08 126.85 74.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.649 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 12.0 mtt180 -99.18 133.64 43.18 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.36 0.6 . . . . 0.0 111.65 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.543 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 4.8 tp-100 -111.21 107.47 16.8 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.53 46.53 1.84 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.733 0.778 . . . . 0.0 109.264 -179.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.35 23.64 9.18 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.896 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.618 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.2 tt0 -122.16 119.19 30.57 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.381 -0.199 . . . . 0.0 110.776 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.498 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 1.2 m-20 -58.85 146.66 36.56 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.709 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 178.67 -169.39 40.89 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.082 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.28 137.2 53.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.979 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.48 137.79 35.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.917 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . 0.416 ' CD1' ' HE2' ' B' ' 41' ' ' PHE . 68.6 m-85 -131.96 117.4 18.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.784 HD11 HG13 ' B' ' 92' ' ' VAL . 12.3 mt -100.42 119.12 37.98 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.501 -178.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -95.44 161.85 13.9 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -20.43 63.14 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.54 -22.2 11.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -178.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . 0.507 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 1.6 ptp180 -155.28 160.86 41.11 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.713 -0.795 . . . . 0.0 112.592 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.911 HD12 HD11 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -104.0 122.15 56.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 114.81 -1.086 . . . . 0.0 108.282 179.028 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.403 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -125.84 155.37 41.27 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.182 0.515 . . . . 0.0 111.29 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.979 ' HB2' HD12 ' B' ' 24' ' ' LEU . 50.4 t90 -147.23 134.69 20.83 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.904 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -117.67 133.77 23.27 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.033 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 1.005 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 2.3 Cg_endo -77.14 146.38 25.35 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.377 2.051 . . . . 0.0 111.923 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.709 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 34.3 mt-10 -64.01 129.46 40.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.297 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.45 -0.02 61.35 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.439 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 1.005 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.9 mptt -113.42 154.37 27.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.322 . . . . 0.0 110.768 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -100.94 4.72 42.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.451 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -140.03 157.17 46.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.209 0.528 . . . . 0.0 111.895 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.416 ' HE2' ' CD1' ' B' ' 25' ' ' TYR . 61.2 m-85 -85.21 126.05 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.756 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.7 p -93.07 -19.07 21.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.263 0.554 . . . . 0.0 110.381 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.704 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 37.1 mm -110.71 118.63 57.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.23 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 43.6 t -147.8 101.33 3.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -126.36 138.82 53.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.785 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.512 ' O ' HG12 ' B' ' 50' ' ' ILE . 18.9 mmt -84.33 144.23 28.98 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.676 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.8 m-85 -61.45 -20.6 63.3 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.962 0.41 . . . . 0.0 110.564 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.59 -11.36 60.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.436 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.541 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.05 -11.56 15.28 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.204 0.526 . . . . 0.0 109.655 179.277 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.682 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.2 mm -91.38 131.0 39.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.43 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 34.7 tttm -87.83 -43.38 11.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.359 0.6 . . . . 0.0 109.745 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.505 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.9 p -164.94 -177.59 4.75 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.261 -0.882 . . . . 0.0 109.602 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.67 142.2 41.13 Favored 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.126 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.088 ' HD3' ' HB3' ' A' ' 403' ' ' PHE . 50.2 mttp -105.28 150.89 24.76 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.55 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.95 129.39 71.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.463 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -93.41 121.49 64.97 Favored Pre-proline 0 C--O 1.252 1.21 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -68.15 172.89 10.29 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 125.071 3.847 . . . . 0.0 114.53 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -63.44 160.43 16.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.39 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.75 -29.19 7.97 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.734 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 22.7 mttp -88.47 155.2 19.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.47 -17.69 63.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.974 0.416 . . . . 0.0 110.991 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.607 ' HD3' ' CE1' ' B' ' 78' ' ' HIS . 17.3 pttt -132.47 134.21 44.78 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.731 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.604 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -78.84 134.9 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.63 ' OE1' ' HD3' ' B' ' 60' ' ' LYS . 0.2 OUTLIER -134.0 163.04 30.43 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 118.085 -1.446 . . . . 0.0 114.811 -176.165 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.428 ' HA ' ' O ' ' B' ' 54' ' ' LYS . 2.2 tp -141.95 153.51 44.38 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 113.111 -1.859 . . . . 0.0 107.24 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.033 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.53 141.71 28.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 118.93 0.787 . . . . 0.0 110.52 178.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.911 HD11 HD12 ' B' ' 31' ' ' ILE . 96.1 mt -93.83 100.28 12.49 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.884 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.642 ' HA ' HG22 ' B' ' 74' ' ' THR . 11.4 t -86.15 111.88 21.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.467 HD12 ' HB3' ' B' ' 73' ' ' ASP . 6.4 mt -94.26 156.6 16.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.998 0.428 . . . . 0.0 111.543 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.541 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -80.16 -1.4 40.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.248 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.28 -3.96 56.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.542 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.11 19.41 53.23 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.54 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . 0.467 ' HB3' HD12 ' B' ' 69' ' ' LEU . 21.7 t70 -125.96 158.9 34.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.254 . . . . 0.0 110.533 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.642 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.5 p -137.87 131.05 30.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.234 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.547 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.6 m -107.39 103.42 12.76 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.69 143.85 30.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.072 0.463 . . . . 0.0 112.162 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.704 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 41.6 m-85 -126.64 127.26 44.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.222 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.649 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.5 t-160 -92.37 101.3 13.77 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.178 -178.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.708 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 24.8 m-85 -79.37 99.52 7.19 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.79 9.9 24.69 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.8 91.43 7.05 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.636 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.83 -41.94 1.69 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.451 -178.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -59.75 4.78 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.452 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.7 p -127.79 7.34 6.18 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 115.747 1.758 . . . . 0.0 115.747 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.708 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.73 -47.33 7.87 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.4 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.76 -51.44 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 111.084 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.452 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.5 mptt -69.06 -34.26 74.88 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.053 0.454 . . . . 0.0 109.858 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.687 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.9 mt-10 -64.83 -44.42 89.9 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.604 ' HD3' HG23 ' B' ' 63' ' ' ILE . 24.0 ttp180 -54.91 -47.18 74.7 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 122.052 0.929 . . . . 0.0 108.509 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . 0.603 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.51 -45.37 93.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.27 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.54 79.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.689 0.222 . . . . 0.0 111.411 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.784 HG13 HD11 ' B' ' 26' ' ' LEU . 46.8 t -61.69 -41.54 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.603 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.0 OUTLIER -59.87 -58.47 8.42 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.545 177.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.7 -51.42 63.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.937 -1.028 . . . . 0.0 112.31 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.765 ' HG ' HD12 ' B' ' 99' ' ' LEU . 15.5 tp -62.04 -42.61 99.36 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.844 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.461 HD12 HG12 ' B' ' 92' ' ' VAL . 20.7 mt -68.89 -41.03 78.84 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -64.2 -23.45 67.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 122.094 0.95 . . . . 0.0 109.116 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -84.08 -50.82 7.6 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.237 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.765 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.3 mt -75.25 -49.86 17.95 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 113.47 -1.696 . . . . 0.0 115.103 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.682 HD22 ' HB ' ' B' ' 50' ' ' ILE . 54.6 mt -50.36 -58.41 9.89 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.608 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.9 Cg_exo -54.96 -20.71 23.96 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.19 1.927 . . . . 0.0 113.448 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -88.0 -6.79 57.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.764 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 . . . . . 0 C--N 1.331 -0.235 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.599 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.818 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 51.0 tt0 . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.636 ' HB3' ' HE2' ' A' ' 403' ' ' PHE . 3.5 m-20 -144.95 89.63 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.521 -177.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.507 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.0 -48.11 0.49 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -74.39 20.57 0.11 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.694 0.759 . . . . 0.0 111.18 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.655 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.4 OUTLIER -54.37 132.09 43.43 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.328 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.319 -0.719 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.963 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.457 HG11 HG12 ' B' ' 11' ' ' ILE . 63.7 t . . . . . 0 N--CA 1.445 -0.707 0 CA-C-O 121.153 0.501 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.41 ' HB2' HD21 ' B' ' 95' ' ' LEU . 31.8 mt -81.3 -33.8 32.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.623 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.401 ' CD2' HG22 ' B' ' 92' ' ' VAL . 6.2 tp -132.11 128.63 38.55 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.457 HG12 HG11 ' B' ' 8' ' ' VAL . 66.3 mt -111.64 122.0 65.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.847 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.6 t -113.57 149.89 15.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.612 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -116.71 179.32 4.04 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.666 -178.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 18.21 66.87 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 O-C-N 125.356 1.66 . . . . 0.0 113.491 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.612 HG23 ' O ' ' B' ' 13' ' ' LYS . 14.9 t -115.05 123.67 70.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.482 179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 54.3 mtt85 -97.44 122.34 40.37 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.233 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.7 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 0.7 OUTLIER -104.84 102.31 11.86 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 178.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.7 mttt 51.53 61.52 3.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.735 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.77 12.82 1.39 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 177.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.74 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 7.0 pt20 -130.52 125.88 35.41 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.393 0.997 . . . . 0.0 111.007 178.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -80.33 152.74 28.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -177.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.419 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . 175.68 -159.17 26.76 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.948 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.23 137.53 52.91 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.944 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.21 140.25 35.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.729 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . 0.436 ' CD2' ' HE2' ' B' ' 41' ' ' PHE . 55.4 m-85 -134.83 122.9 22.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.878 HD11 HG13 ' B' ' 92' ' ' VAL . 15.8 mt -103.18 118.01 35.83 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.564 -0.455 . . . . 0.0 111.797 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -93.36 163.01 13.76 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.08 -21.98 60.07 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -115.25 -15.46 11.61 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . 0.531 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -158.83 166.6 31.52 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 119.744 -0.782 . . . . 0.0 112.892 -177.007 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.863 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -110.23 122.46 64.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.912 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.471 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -124.14 152.81 42.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.085 0.469 . . . . 0.0 110.656 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.944 ' HB2' HD12 ' B' ' 24' ' ' LEU . 25.2 t90 -146.96 140.08 25.32 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -128.82 140.0 37.27 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.522 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.875 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 22.0 Cg_exo -64.02 158.48 47.39 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.625 2.217 . . . . 0.0 111.752 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.23 122.03 11.51 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.383 0.611 . . . . 0.0 111.967 -178.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.36 29.73 59.64 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.308 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.875 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.48 146.72 39.14 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.046 0.423 . . . . 0.0 110.295 178.837 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -92.91 -20.75 20.33 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.938 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -113.18 144.43 42.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.48 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.436 ' HE2' ' CD2' ' B' ' 25' ' ' TYR . 84.5 m-85 -85.74 122.43 29.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.727 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.82 -17.5 33.27 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.351 0.596 . . . . 0.0 110.278 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.707 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -112.64 119.86 61.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.153 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.0 t -148.0 101.45 3.29 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.479 ' CD2' HG23 ' B' ' 43' ' ' ILE . 61.6 m-70 -126.59 131.09 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.669 0.271 . . . . 0.0 110.282 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.531 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 67.8 mmm -83.36 143.12 30.54 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.646 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.87 -24.21 56.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.025 0.441 . . . . 0.0 110.571 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.16 -9.03 58.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.922 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.71 ' HA ' ' HE2' ' B' ' 70' ' ' HIS . 34.7 m-20 -109.92 -8.83 14.81 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.214 0.53 . . . . 0.0 110.039 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.556 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.0 OUTLIER -88.28 129.47 39.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.049 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.435 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 31.0 tttp -86.01 -38.72 17.6 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.657 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.3 p -167.24 178.81 5.39 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.513 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . 0.422 HE22 ' HG3' ' B' ' 93' ' ' LYS . 1.9 pp0? -142.41 135.82 28.91 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.416 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.006 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 34.0 mttm -105.79 155.5 19.23 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.001 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.541 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -128.12 129.99 69.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 176.453 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.42 122.37 63.05 Favored Pre-proline 0 C--O 1.25 1.107 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.661 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.21 172.89 11.3 Favored 'Trans proline' 0 C--O 1.235 0.342 1 C-N-CA 125.48 4.12 . . . . 0.0 114.657 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -65.14 160.41 21.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.824 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.42 -28.99 8.21 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.818 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 7.5 mttp -85.76 162.38 18.74 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.98 -17.73 60.49 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.114 0.483 . . . . 0.0 110.331 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.661 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 13.8 pttp -135.16 133.89 39.61 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.149 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.558 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.1 mp -79.58 129.91 36.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.544 ' OE1' ' HD3' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -133.13 163.68 28.73 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -175.11 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.524 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -139.37 153.02 47.59 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 112.963 -1.926 . . . . 0.0 106.432 176.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.006 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.1 135.33 22.82 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 119.405 1.002 . . . . 0.0 111.545 179.408 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.863 HD11 HD13 ' B' ' 31' ' ' ILE . 76.7 mt -93.72 99.18 11.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.477 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.657 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.2 t -85.11 105.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.476 HD22 HD13 ' B' ' 50' ' ' ILE . 4.3 mt -89.88 155.7 18.97 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.146 0.498 . . . . 0.0 112.08 -177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.71 ' HE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -81.4 4.32 21.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.718 0.771 . . . . 0.0 109.002 177.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -86.27 -5.84 59.1 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.206 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.46 13.96 56.33 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.095 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -126.27 155.14 42.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.761 0.315 . . . . 0.0 110.848 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.585 HG22 ' HA ' ' B' ' 68' ' ' VAL . 10.0 p -127.37 131.23 50.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.521 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.557 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.84 98.75 8.38 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.787 0.327 . . . . 0.0 110.16 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.485 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.7 m-20 -86.29 147.95 25.84 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.096 0.474 . . . . 0.0 111.381 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.707 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 61.4 m-85 -131.9 116.57 17.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.691 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.541 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.9 t-160 -86.95 103.48 15.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.61 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.684 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 51.2 m-85 -76.5 96.91 4.19 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.96 19.53 20.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.44 ' HA ' HD22 ' B' ' 81' ' ' ASN . 1.0 OUTLIER -90.91 93.6 9.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.291 0.567 . . . . 0.0 109.589 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.76 -32.64 0.63 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.01 -59.47 2.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.526 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.5 p -127.39 10.86 6.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -176.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.684 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.39 -52.1 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.442 HG22 HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.75 -50.58 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.691 0.281 . . . . 0.0 111.221 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.526 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.7 mttt -67.53 -33.63 75.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.648 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.1 mt-10 -64.63 -44.41 90.59 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.558 ' HD3' HG23 ' B' ' 63' ' ' ILE . 20.7 ttp180 -56.43 -47.1 79.79 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.68 -41.9 99.34 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.757 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.8 -41.47 78.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.614 0.188 . . . . 0.0 111.243 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.878 HG13 HD11 ' B' ' 26' ' ' LEU . 38.6 t -62.4 -43.53 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.422 ' HG3' HE22 ' B' ' 53' ' ' GLN . 0.5 OUTLIER -58.06 -52.79 64.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.096 178.061 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -57.16 -53.49 57.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.605 -179.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.802 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.3 tp -63.61 -36.98 85.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.008 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.8 mt -70.42 -45.1 66.56 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 110.43 -0.211 . . . . 0.0 110.43 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -62.43 -21.27 65.28 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.007 0.908 . . . . 0.0 109.461 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.34 -47.41 9.39 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.194 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.802 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.2 mt -81.44 -46.29 14.79 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -176.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.646 HD23 ' HB3' ' B' ' 47' ' ' TYR . 38.3 mt -52.38 -58.19 12.62 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.619 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 59.2 Cg_exo -54.68 -19.85 19.84 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.325 2.016 . . . . 0.0 113.829 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -84.88 -21.19 29.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 0.0 111.346 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 C--N 1.327 -0.377 0 CA-C-O 120.659 0.266 . . . . 0.0 111.355 -179.471 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.88 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.5 tt0 . . . . . 0 CA--C 1.513 -0.452 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.733 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -136.37 89.52 2.48 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 -176.199 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.0 p-10 -139.31 -46.6 0.46 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -72.92 9.37 1.18 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.24 0.543 . . . . 0.0 110.846 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.673 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -50.25 120.26 4.37 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.033 179.812 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.32 -0.717 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.325 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 42.9 t . . . . . 0 CA--C 1.52 -0.195 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 73.9 mt -91.09 -29.34 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.931 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.498 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -139.65 131.32 27.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 78.9 mt -115.05 122.68 69.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.859 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.7 t -114.33 150.34 16.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.647 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.7 mtmp? -114.8 177.22 4.73 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.488 -178.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.579 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.71 73.33 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 O-C-N 125.152 1.533 . . . . 0.0 113.343 -178.395 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.724 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.6 t -126.12 129.36 72.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.396 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.68 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 0.3 OUTLIER -99.6 145.19 27.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.053 0.454 . . . . 0.0 111.332 179.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.656 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -132.48 103.22 6.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.169 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.46 ' HG3' HE22 ' B' ' 17' ' ' GLN . 35.2 mttp 58.82 54.39 5.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.929 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? 72.19 23.99 3.22 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.898 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.68 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 36.9 mt-30 -126.29 119.63 27.88 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.559 ' HA ' ' HG3' ' B' ' 16' ' ' ARG . 0.8 OUTLIER -85.36 139.18 31.77 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.918 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -174.37 -151.06 8.07 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.753 -0.736 . . . . 0.0 113.589 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.3 140.18 52.38 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 122.73 0.412 . . . . 0.0 110.008 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.943 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -102.03 145.7 28.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.471 -178.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -139.33 112.77 8.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.735 0.303 . . . . 0.0 110.357 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.983 HD11 HG13 ' B' ' 92' ' ' VAL . 12.1 mt -90.27 137.23 32.51 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.13 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . 0.532 ' HB3' ' NH2' ' B' ' 30' ' ' ARG . 42.8 mtt -120.8 167.19 12.77 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.028 -178.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.14 -49.76 8.89 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -122.75 11.59 9.76 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.458 -178.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . 0.578 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.0 OUTLIER -159.6 156.4 27.92 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.253 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 1.024 HD13 HD11 ' B' ' 67' ' ' LEU . 1.5 tt -111.59 122.01 65.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -120.17 150.84 40.0 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.983 0.42 . . . . 0.0 110.775 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.943 ' HB2' HD12 ' B' ' 24' ' ' LEU . 48.2 t90 -146.99 141.2 26.19 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.868 ' HB1' ' HD3' ' B' ' 38' ' ' LYS . . . -139.6 129.46 14.11 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.56 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.918 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 21.1 Cg_endo -62.87 167.42 12.1 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.873 2.382 . . . . 0.0 112.489 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.54 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 72.4 mt-10 -81.65 124.0 29.19 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.479 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 118.36 -30.29 6.07 Favored Glycine 0 C--O 1.228 -0.281 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.766 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.868 ' HD3' ' HB1' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -75.14 171.73 13.64 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.499 0.666 . . . . 0.0 111.762 -179.943 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . 0.519 ' OD1' ' HG3' ' B' ' 40' ' ' ARG . 18.1 p-10 -115.74 -23.07 8.84 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.168 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.519 ' HG3' ' OD1' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -117.72 149.54 40.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.368 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.526 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 50.5 m-85 -70.32 154.61 41.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.576 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.8 p -115.48 -43.3 3.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.258 0.552 . . . . 0.0 109.801 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.656 HG13 ' HG3' ' B' ' 17' ' ' GLN . 18.6 mm -91.44 121.21 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.931 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 23.0 t -147.64 101.39 3.33 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.42 ' CD2' HG23 ' B' ' 43' ' ' ILE . 77.5 m-70 -125.94 138.78 53.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.919 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 78.8 mmm -88.85 143.75 26.68 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.569 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -58.12 -20.73 42.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.304 0.573 . . . . 0.0 109.802 178.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . 0.502 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -72.81 -18.52 61.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.81 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.63 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.79 -6.36 21.53 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 123.46 0.475 . . . . 0.0 110.232 -179.731 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.59 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.6 mm -90.37 130.58 39.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.441 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 31.8 tttp -91.06 -44.41 9.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.488 0.661 . . . . 0.0 110.427 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.625 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.2 p -158.25 -177.31 6.46 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.497 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' B' ' 96' ' ' LEU . 5.0 pt20 -145.3 148.77 33.8 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.793 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.087 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 42.2 mttm -117.03 154.11 31.5 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 176.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.696 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -130.22 128.72 64.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.801 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.6 p -88.81 119.8 69.99 Favored Pre-proline 0 C--O 1.249 1.042 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.155 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.76 173.54 13.79 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 125.255 3.97 . . . . 0.0 114.275 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -59.45 160.93 6.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.127 178.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.18 -29.25 7.79 Favored Glycine 0 C--N 1.317 -0.477 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -177.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.88 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.5 mttp -89.51 153.14 21.03 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.29 -3.36 16.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.249 0.547 . . . . 0.0 110.64 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.81 154.26 45.09 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.288 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.628 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -99.85 135.23 36.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.417 ' HB2' HE21 ' B' ' 64' ' ' GLN . 6.1 mt-30 -137.79 162.95 32.58 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.844 -1.142 . . . . 0.0 113.991 -177.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.644 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.4 tp -139.92 153.66 47.01 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.276 177.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.087 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -143.87 141.3 30.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.938 0.79 . . . . 0.0 111.278 178.742 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 1.024 HD11 HD13 ' B' ' 31' ' ' ILE . 64.7 mt -97.77 103.78 15.75 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.145 178.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.669 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.8 t -87.16 105.91 15.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.562 HD22 HD13 ' B' ' 50' ' ' ILE . 3.4 mt -91.18 158.1 16.81 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.012 -177.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.63 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.15 -1.68 45.47 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.162 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.76 -10.69 59.67 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.475 -1.238 . . . . 0.0 110.314 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.84 12.86 48.75 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.058 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -126.33 158.14 36.61 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.964 0.412 . . . . 0.0 110.929 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.669 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.9 p -128.59 131.6 48.17 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.6 m -104.37 105.34 15.44 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.359 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.733 HD21 ' HB3' ' A' ' 400' ' ' ASP . 5.0 m-20 -82.29 136.97 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.363 0.602 . . . . 0.0 111.956 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.422 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.1 m-85 -121.63 110.85 16.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.598 178.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.724 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.8 t60 -86.53 99.1 11.44 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.658 -1.155 . . . . 0.0 111.804 -177.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.644 ' HE1' ' HB2' ' B' ' 65' ' ' LEU . 71.6 m-85 -77.26 94.24 4.11 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 178.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.18 1.54 39.17 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.579 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -79.99 91.38 5.44 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.86 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.82 -39.68 2.59 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.6 -59.62 4.36 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.523 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.4 p -127.81 9.0 6.35 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -176.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.526 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.23 -50.71 6.4 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.4 -51.91 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.82 0.343 . . . . 0.0 110.811 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.523 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.3 mttt -66.6 -35.17 79.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.874 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.653 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -63.35 -46.54 86.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.636 ' HD2' HD12 ' B' ' 55' ' ' ILE . 22.2 ttp180 -55.73 -48.47 75.14 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . 0.536 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -61.56 -44.66 96.62 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.052 -1.431 . . . . 0.0 112.502 -179.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -43.19 76.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.89 0.314 . . . . 0.0 111.097 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.983 HG13 HD11 ' B' ' 26' ' ' LEU . 58.0 t -60.8 -43.57 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.696 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.2 tmmt? -60.37 -55.9 27.95 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.813 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -53.32 -55.39 25.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.891 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.766 ' HG ' HD12 ' B' ' 99' ' ' LEU . 14.0 tp -60.96 -41.25 95.99 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.96 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.509 HD12 HG12 ' B' ' 92' ' ' VAL . 27.1 mt -69.36 -42.79 74.77 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.392 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -66.0 -18.51 65.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.903 0.859 . . . . 0.0 109.368 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.02 -51.01 6.62 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.759 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.766 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -77.48 -48.15 17.83 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.451 -1.704 . . . . 0.0 115.019 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.59 HD22 ' HB ' ' B' ' 50' ' ' ILE . 19.0 mt -48.92 -56.29 16.07 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 19.6 Cg_endo -57.05 -15.33 17.21 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.27 1.98 . . . . 0.0 114.034 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.2 mttm -87.59 -20.51 26.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.502 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 26.7 m-85 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.514 ' HB3' ' HE2' ' B' ' 62' ' ' LYS . 7.2 tt0 . . . . . 0 CA--C 1.507 -0.685 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.898 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.6 OUTLIER -170.63 83.97 0.1 Allowed 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.929 -177.625 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.458 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.7 p-10 -138.52 -46.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . 0.491 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 2.6 p30 -72.8 7.25 2.06 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.498 0.666 . . . . 0.0 110.208 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 1.009 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -54.1 126.51 23.01 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.794 179.467 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 . . . . . 0 C--N 1.322 -0.606 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.016 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 79.7 t . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.4 mt -84.44 -29.54 26.01 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.728 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.492 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.32 125.56 29.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.9 mt -112.68 116.07 51.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.773 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -107.05 147.77 11.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.575 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -107.84 175.38 5.5 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.051 -178.54 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.657 ' HE2' ' HA ' ' B' ' 81' ' ' ASN . 29.3 mtpt 18.23 76.17 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 O-C-N 125.147 1.53 . . . . 0.0 113.552 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.575 HG23 ' O ' ' B' ' 13' ' ' LYS . 40.1 t -124.2 120.14 58.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.811 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.579 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 26.3 mtp180 -90.85 125.9 35.88 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.223 0.535 . . . . 0.0 111.032 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.429 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 2.8 tp-100 -117.21 112.18 20.47 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.891 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.1 OUTLIER 66.12 43.18 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.601 0.563 . . . . 0.0 110.639 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 70.59 19.28 6.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.472 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.499 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tt0 -125.93 119.22 27.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.452 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.433 ' CG ' ' HG2' ' B' ' 16' ' ' ARG . 2.2 m-20 -68.68 153.74 43.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.037 0.446 . . . . 0.0 111.689 -179.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 178.43 -158.88 23.83 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.038 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 134.59 49.99 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.218 0.532 . . . . 0.0 110.62 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.938 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.33 139.73 32.85 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.509 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -135.94 108.52 7.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.584 0.23 . . . . 0.0 110.417 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.929 HD11 HG13 ' B' ' 92' ' ' VAL . 9.3 mt -86.84 125.65 34.12 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . 0.628 ' HB2' ' HD2' ' B' ' 30' ' ' ARG . 5.4 mtm -106.69 173.67 6.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.921 0.391 . . . . 0.0 111.57 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.42 -52.9 7.39 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -118.22 8.03 12.23 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . 0.628 ' HD2' ' HB2' ' B' ' 27' ' ' MET . 0.0 OUTLIER -158.7 151.0 21.55 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.95 -1.1 . . . . 0.0 112.666 -178.249 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.961 HD13 HD11 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -97.69 122.77 49.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.576 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -124.78 156.64 37.4 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.993 0.425 . . . . 0.0 110.828 -179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.938 ' HB2' HD12 ' B' ' 24' ' ' LEU . 39.1 t90 -147.12 132.72 18.78 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.453 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -114.7 136.25 22.44 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.105 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.871 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 24.0 Cg_exo -61.57 159.06 33.75 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.19 1.927 . . . . 0.0 111.062 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -62.47 134.54 56.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.308 0.575 . . . . 0.0 111.682 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 62.62 12.35 40.24 Favored Glycine 0 CA--C 1.521 0.414 0 CA-C-N 115.552 -0.749 . . . . 0.0 113.993 179.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.871 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 40.4 mttp -113.43 140.77 47.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.384 0.592 . . . . 0.0 110.807 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -85.18 -14.12 47.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.141 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.439 ' HG2' ' H ' ' B' ' 40' ' ' ARG . 2.2 ptp180 -106.13 129.9 54.12 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.188 0.518 . . . . 0.0 112.322 -178.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.442 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 45.3 m-85 -78.19 121.14 23.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.26 178.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 7.5 p -94.62 -7.72 40.1 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.642 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -119.95 118.65 57.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.306 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.2 t -148.01 101.61 3.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.823 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -124.13 137.22 54.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.465 ' O ' HG12 ' B' ' 50' ' ' ILE . 33.0 mtp -88.94 142.32 27.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.638 ' HB3' ' HA ' ' B' ' 100' ' ' LEU . 20.4 m-85 -57.5 -23.0 47.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.696 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.26 -27.21 65.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.938 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.564 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.15 -5.84 43.14 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.873 0.368 . . . . 0.0 111.147 -179.025 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.766 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -89.36 129.86 39.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.608 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 1.1 tttp -90.06 -41.39 11.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.201 0.524 . . . . 0.0 110.641 -178.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.608 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 4.7 p -163.79 -177.6 5.23 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.76 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . 0.664 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 5.5 pt20 -140.58 145.49 36.8 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.371 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.063 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 53.6 mttp -108.39 136.7 47.59 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.491 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -118.78 124.63 73.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 176.056 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.41 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -85.04 118.35 70.7 Favored Pre-proline 0 C--O 1.25 1.102 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -178.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 68.8 Cg_endo -68.88 173.24 10.46 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 125.117 3.878 . . . . 0.0 113.996 -178.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 160.5 5.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.482 -1.235 . . . . 0.0 109.885 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.13 7.91 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.491 ' HG3' ' OD2' ' A' ' 402' ' ' ASP . 5.6 mttp -86.82 153.79 21.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.57 -14.14 62.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.436 0.636 . . . . 0.0 109.944 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.514 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -137.69 141.79 41.08 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.557 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.508 HG21 ' HA ' ' B' ' 86' ' ' VAL . 3.8 mp -84.27 133.81 28.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -134.57 162.89 31.03 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 118.559 -1.256 . . . . 0.0 114.359 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.488 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.82 152.96 46.94 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 113.791 -1.55 . . . . 0.0 107.909 177.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.063 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.72 145.58 30.03 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.629 0.649 . . . . 0.0 110.48 177.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.961 HD11 HD13 ' B' ' 31' ' ' ILE . 96.1 mt -96.94 111.7 23.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.052 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.556 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.1 t -95.54 112.86 28.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.618 HD22 HD13 ' B' ' 50' ' ' ILE . 1.7 mt -97.43 158.46 15.46 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.564 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -80.21 -1.77 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.29 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.403 ' HB3' ' OD1' ' B' ' 73' ' ' ASP . . . -73.46 -16.68 61.3 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.67 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 103.02 8.66 41.4 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.899 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . 0.507 ' OD1' HD12 ' B' ' 69' ' ' LEU . 8.0 p-10 -126.42 172.24 10.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.199 0.523 . . . . 0.0 111.841 -179.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.556 HG22 ' HA ' ' B' ' 68' ' ' VAL . 30.4 p -137.58 143.57 41.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.574 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.554 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 16.7 m -116.82 109.38 17.02 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.504 0.322 . . . . 0.0 110.511 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.898 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.9 m-20 -82.31 154.46 25.3 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.38 0.61 . . . . 0.0 112.628 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.642 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.7 m-85 -141.5 104.01 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.834 -1.075 . . . . 0.0 108.834 178.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.579 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.2 t-160 -86.9 105.28 16.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.493 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.62 ' CE1' HG11 ' B' ' 12' ' ' VAL . 48.9 m-85 -76.71 101.61 5.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.3 p -95.62 7.27 46.75 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.949 0.404 . . . . 0.0 111.69 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.657 ' HA ' ' HE2' ' B' ' 14' ' ' LYS . 63.8 t30 -86.09 90.81 8.23 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -33.66 18.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 41.1 m -58.89 -59.96 4.62 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.486 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.78 13.15 6.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.513 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -46.52 -45.01 18.27 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.508 ' HA ' HG21 ' B' ' 63' ' ' ILE . 2.9 t -59.57 -54.72 30.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.006 0.432 . . . . 0.0 110.563 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.486 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.7 mptt -65.56 -36.76 84.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.192 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.686 ' O ' HG23 ' B' ' 92' ' ' VAL . 14.0 mt-10 -65.04 -43.56 91.97 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.498 ' HD3' HG23 ' B' ' 63' ' ' ILE . 23.9 ttp180 -56.6 -49.26 75.45 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.51 -42.75 97.06 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.368 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -44.1 78.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.822 0.283 . . . . 0.0 110.97 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.929 HG13 HD11 ' B' ' 26' ' ' LEU . 38.9 t -60.26 -43.63 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.664 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 2.9 ttpt -60.19 -53.42 57.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.138 178.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 2.1 m-20 -56.3 -51.25 68.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.879 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.722 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.7 tp -64.89 -37.39 87.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.719 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.413 HD12 HG12 ' B' ' 92' ' ' VAL . 27.9 mt -72.31 -47.59 48.72 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 121.308 -0.157 . . . . 0.0 111.06 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . 0.515 ' N ' HE22 ' B' ' 53' ' ' GLN . 13.5 pt20 -60.01 -21.66 61.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.193 0.997 . . . . 0.0 109.143 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.421 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 1.4 mm-40 -85.94 -47.83 9.26 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.135 -1.393 . . . . 0.0 111.363 178.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.722 HD12 ' HG ' ' B' ' 95' ' ' LEU . 13.6 mt -81.84 -38.69 25.09 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.766 HD22 ' HB ' ' B' ' 50' ' ' ILE . 30.2 mt -53.14 -62.66 3.18 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -66.51 -7.7 18.64 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.815 1.677 . . . . 0.0 113.36 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 12.4 mtmm -81.26 -31.87 33.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.784 0.326 . . . . 0.0 110.309 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 . . . . . 0 C--N 1.327 -0.411 0 CA-C-O 121.196 0.522 . . . . 0.0 110.614 179.854 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.89 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 65.1 tt0 . . . . . 0 CA--C 1.506 -0.724 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.612 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 2.4 m-20 -140.87 92.05 2.47 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.451 -175.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.521 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.4 OUTLIER -139.51 -48.39 0.47 Allowed 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -73.13 17.5 0.13 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.636 0.731 . . . . 0.0 111.229 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.921 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -55.64 128.74 36.09 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.878 179.124 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 . . . . . 0 C--N 1.317 -0.838 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.4 -179.142 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 70.2 t . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.682 ' HB2' HD21 ' B' ' 95' ' ' LEU . 23.0 mt -87.04 -28.9 22.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.158 -178.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.447 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -140.1 138.24 35.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 86.1 mt -121.75 126.47 74.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.699 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.0 t -118.25 148.24 21.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.638 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -110.62 -178.68 3.55 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.349 -179.358 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.494 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 47.8 mtpt 18.06 69.39 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 O-C-N 125.42 1.7 . . . . 0.0 113.559 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.638 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.5 t -119.17 123.35 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.558 179.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.639 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 13.8 mtp-105 -98.14 121.36 39.97 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.086 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.446 HE21 ' HB3' ' B' ' 17' ' ' GLN . 0.7 OUTLIER -105.63 103.29 12.77 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.157 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 50.9 mttt 52.81 62.87 2.47 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.761 0.663 . . . . 0.0 110.937 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? 68.43 24.61 7.13 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 113.088 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.639 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 20.5 mt-30 -129.84 119.31 23.13 Favored 'General case' 0 C--O 1.222 -0.375 0 O-C-N 122.23 -0.293 . . . . 0.0 111.275 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -75.08 145.04 42.64 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.149 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.33 -167.64 39.34 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.653 -0.784 . . . . 0.0 113.613 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.86 137.68 54.69 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.125 0.57 . . . . 0.0 109.803 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.928 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -100.54 140.82 34.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.232 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -135.62 124.67 24.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.844 HD11 HG13 ' B' ' 92' ' ' VAL . 16.0 mt -108.03 122.85 47.7 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.668 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -103.35 160.88 14.31 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.49 -22.24 54.36 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -105.96 -23.23 12.71 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' B' ' 45' ' ' HIS . 0.0 OUTLIER -160.38 172.72 16.78 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.692 -0.803 . . . . 0.0 112.879 -176.582 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.983 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -112.67 122.89 67.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.742 178.3 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.473 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -122.57 150.45 42.59 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.928 ' HB2' HD12 ' B' ' 24' ' ' LEU . 36.8 t90 -146.87 137.02 23.49 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -123.86 142.32 39.15 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.5 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.1 159.08 48.45 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.379 2.053 . . . . 0.0 111.167 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.12 137.37 57.98 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.379 -179.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.8 29.81 75.84 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.333 -0.849 . . . . 0.0 113.192 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.444 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 19.1 mmtm -113.7 151.82 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.057 0.429 . . . . 0.0 110.936 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -99.82 -12.76 19.62 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.866 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -123.49 146.41 48.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.059 0.457 . . . . 0.0 111.571 -178.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -87.06 121.64 29.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.002 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.4 p -85.84 -23.65 27.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.34 0.59 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.6 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 16.4 mm -103.42 118.74 50.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.018 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 33.4 t -147.83 101.45 3.31 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.502 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 68.9 m-70 -124.67 132.03 53.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.221 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.536 ' O ' HG12 ' B' ' 50' ' ' ILE . 81.1 mmm -81.85 143.32 31.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.468 ' CE1' HD13 ' B' ' 99' ' ' LEU . 22.3 m-30 -56.97 -24.08 50.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 110.608 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.22 -27.55 64.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.992 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.575 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -93.35 -7.16 45.57 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.021 0.438 . . . . 0.0 110.683 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.625 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.0 mm -87.88 130.64 37.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.863 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 1.5 ttpt -87.52 -37.58 16.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.298 0.571 . . . . 0.0 109.817 -179.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.863 ' SG ' ' HE2' ' B' ' 51' ' ' LYS . 21.8 p -171.89 -178.13 2.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.78 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -143.33 140.77 30.7 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.262 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.062 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.8 mttp -107.04 156.17 19.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.527 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.6 OUTLIER -131.56 131.57 62.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 176.227 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.11 120.77 66.66 Favored Pre-proline 0 C--O 1.252 1.209 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.59 172.75 12.85 Favored 'Trans proline' 0 C--O 1.233 0.246 1 C-N-CA 125.319 4.013 . . . . 0.0 114.57 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -64.04 160.48 17.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.158 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.72 -29.03 8.08 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -178.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.89 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.6 mttp -86.96 160.36 18.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.9 -9.86 59.63 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.401 0.62 . . . . 0.0 109.658 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.638 ' HD3' ' HB3' ' A' ' 399' ' ' GLU . 3.7 ptmt -134.5 129.82 35.73 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.194 -179.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.48 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -83.53 131.53 33.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 177.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.588 ' CG ' ' HE2' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -137.95 163.88 30.42 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -175.366 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.526 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.5 tp -139.63 153.46 47.33 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.046 -1.888 . . . . 0.0 106.842 176.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.062 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.3 138.02 24.81 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 119.254 0.934 . . . . 0.0 111.451 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.983 HD11 HD13 ' B' ' 31' ' ' ILE . 95.8 mt -94.01 100.54 12.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.923 179.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.703 ' HA ' HG22 ' B' ' 74' ' ' THR . 5.2 t -84.14 104.34 12.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.057 -0.719 . . . . 0.0 109.057 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.613 HD22 HD13 ' B' ' 50' ' ' ILE . 2.9 mt -91.36 158.67 16.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.913 0.387 . . . . 0.0 111.408 -178.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.575 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -81.25 -0.6 41.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.163 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.77 -9.29 58.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.582 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.08 9.7 56.85 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.0 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -126.4 151.58 47.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.927 0.394 . . . . 0.0 110.861 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.703 HG22 ' HA ' ' B' ' 68' ' ' VAL . 21.8 p -121.4 130.34 53.54 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.561 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.5 m -99.02 98.65 9.67 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.439 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.6 m-20 -83.9 143.39 29.9 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.102 0.477 . . . . 0.0 111.28 -178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.454 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 65.2 m-85 -128.85 112.8 14.51 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.131 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.565 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.2 t-160 -86.55 104.75 16.29 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.639 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.697 ' CE2' HG11 ' B' ' 12' ' ' VAL . 52.2 m-85 -76.45 94.32 3.65 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 5.8 p -99.28 12.82 35.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.494 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 40.3 t30 -85.09 91.94 8.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -45.93 -32.38 2.68 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.836 0.854 . . . . 0.0 112.928 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.26 -60.64 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.508 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -128.63 11.88 6.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 -176.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.659 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -42.94 -50.31 5.83 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -52.32 60.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.868 0.366 . . . . 0.0 110.91 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.508 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.45 -35.68 80.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.9 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.682 ' O ' HG23 ' B' ' 92' ' ' VAL . 14.3 mt-10 -64.75 -44.31 90.52 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.502 ' HD2' HD12 ' B' ' 55' ' ' ILE . 20.6 ttp180 -56.18 -48.64 75.97 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.6 -43.83 96.99 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.588 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.4 -42.23 83.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 117.713 0.233 . . . . 0.0 111.178 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.844 HG13 HD11 ' B' ' 26' ' ' LEU . 38.2 t -62.23 -43.85 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.434 ' HB2' HD11 ' B' ' 65' ' ' LEU . 0.6 OUTLIER -57.9 -53.98 52.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.992 178.118 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.7 -54.54 45.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.868 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.863 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.7 tp -62.08 -35.7 79.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.355 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.45 HD12 HG12 ' B' ' 92' ' ' VAL . 28.3 mt -74.41 -47.37 34.24 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' B' ' 97' ' ' GLN . 0.0 OUTLIER -60.29 -21.59 62.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.278 1.037 . . . . 0.0 109.136 178.682 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -87.03 -45.49 10.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.171 -1.377 . . . . 0.0 111.482 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.863 HD12 ' HG ' ' B' ' 95' ' ' LEU . 10.6 mt -85.0 -43.81 13.64 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -176.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.625 HD22 ' HB ' ' B' ' 50' ' ' ILE . 22.7 mt -51.21 -60.51 5.56 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -176.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -59.72 -5.76 3.83 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.496 2.131 . . . . 0.0 114.177 -177.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -85.65 -20.89 28.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.852 0.358 . . . . 0.0 110.486 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.455 179.433 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.952 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.1 tt0 . . . . . 0 CA--C 1.514 -0.427 0 CA-C-O 120.738 0.304 . . . . 0.0 111.548 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.516 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 6.9 p-10 -136.53 91.67 2.68 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.511 0.672 . . . . 0.0 111.725 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.495 ' C ' ' H ' ' A' ' 403' ' ' PHE . 26.3 p-10 -139.16 -47.4 0.48 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -71.92 9.33 0.95 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.515 0.674 . . . . 0.0 110.592 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.798 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -52.03 118.3 3.37 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' B' ' 54' ' ' LYS . 1.0 OUTLIER . . . . . 0 C--N 1.319 -0.739 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.523 HG11 HG12 ' B' ' 11' ' ' ILE . 74.3 t . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 120.905 0.383 . . . . 0.0 110.493 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.6 mt -88.86 -32.17 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.433 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.536 ' HB3' ' HB2' ' B' ' 26' ' ' LEU . 6.1 tp -129.87 123.52 31.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.59 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.523 HG12 HG11 ' B' ' 8' ' ' VAL . 56.5 mt -107.97 120.9 60.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.878 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.2 t -112.13 149.99 14.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.617 ' O ' HG23 ' B' ' 15' ' ' VAL . 2.0 mtmp? -115.9 -179.78 3.75 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.705 -178.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 18.15 63.51 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 O-C-N 125.214 1.571 . . . . 0.0 113.937 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.3 t -113.73 127.09 71.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 84.0 mtt180 -100.6 126.63 47.1 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.409 0.623 . . . . 0.0 111.619 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.497 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 5.6 tp-100 -105.84 103.39 12.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 0.6 OUTLIER 63.89 47.22 3.58 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.658 0.599 . . . . 0.0 110.16 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.4 OUTLIER 74.08 9.22 4.65 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.138 179.364 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.673 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.4 tp-100 -104.89 118.44 36.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.45 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 0.4 OUTLIER -72.11 147.5 46.63 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.328 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.578 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . 178.29 -160.68 26.96 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.904 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.4 136.21 50.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.965 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.32 139.11 33.76 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.298 -179.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . 0.404 ' CE1' HG23 ' B' ' 11' ' ' ILE . 75.7 m-85 -132.63 109.59 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.389 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 1.049 HD11 HG13 ' B' ' 92' ' ' VAL . 9.0 mt -87.46 125.22 34.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.836 0.35 . . . . 0.0 110.892 -179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 41.6 mtt -103.73 164.02 11.95 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.98 -39.18 71.45 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . 0.944 ' HA ' ' HZ ' ' B' ' 103' ' ' PHE . 25.9 mm-40 -113.02 1.49 15.38 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . 0.455 ' NH1' ' HB2' ' B' ' 29' ' ' GLU . 0.0 OUTLIER -161.76 154.61 20.43 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 119.522 -0.871 . . . . 0.0 112.76 -178.064 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.815 HD13 HD11 ' B' ' 67' ' ' LEU . 1.2 tt -102.81 118.13 49.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -118.56 152.2 36.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.398 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.965 ' HB2' HD12 ' B' ' 24' ' ' LEU . 38.1 t90 -147.09 134.71 21.01 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.451 ' HB2' ' CD2' ' B' ' 41' ' ' PHE . . . -120.96 129.61 25.22 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.78 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.641 ' HG2' ' HD3' ' B' ' 38' ' ' LYS . 47.4 Cg_endo -73.55 143.71 34.77 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.498 2.132 . . . . 0.0 111.7 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.557 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 63.2 mt-10 -61.64 131.2 49.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 0.0 110.856 -179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.65 -10.62 60.96 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.834 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.641 ' HD3' ' HG2' ' B' ' 35' ' ' PRO . 5.8 mptt -113.65 152.51 30.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -100.9 -18.5 16.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.68 127.91 53.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.008 0.432 . . . . 0.0 111.816 -178.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.451 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 44.6 m-85 -63.95 121.09 13.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.56 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.38 -34.23 23.62 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.984 0.421 . . . . 0.0 110.843 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.829 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 24.2 mm -93.43 122.69 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.909 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 35.8 t -147.95 101.2 3.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.403 ' CD2' HG23 ' B' ' 43' ' ' ILE . 79.9 m-70 -127.43 140.51 52.12 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.491 ' O ' HG12 ' B' ' 50' ' ' ILE . 27.8 mtp -91.82 144.88 25.04 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.746 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.5 m-30 -60.29 -19.8 56.49 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.838 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.92 -21.53 63.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.379 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.533 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -101.51 -11.28 19.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.001 0.429 . . . . 0.0 110.6 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.751 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.5 mm -88.68 125.89 41.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.642 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 9.3 tmtt? -86.18 -38.04 18.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.03 0.443 . . . . 0.0 109.919 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.642 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 28.3 p -169.55 -177.81 2.86 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.402 -0.817 . . . . 0.0 108.917 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.11 141.94 46.12 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.751 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.064 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 26.9 mttp -102.62 146.7 27.79 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.569 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.77 126.82 69.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.174 -1.046 . . . . 0.0 108.174 177.247 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.449 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.56 118.5 69.09 Favored Pre-proline 0 C--O 1.249 1.062 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.76 173.03 10.65 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 125.079 3.853 . . . . 0.0 114.624 -177.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -61.69 160.51 11.5 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.395 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.02 8.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 109.606 -1.397 . . . . 0.0 109.606 -177.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.952 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 12.8 mttp -87.75 152.66 21.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.06 -11.11 60.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.212 0.529 . . . . 0.0 110.544 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.487 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.95 138.0 35.21 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.661 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.533 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -83.3 140.55 16.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 177.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.449 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 17.4 mt-30 -139.98 162.86 34.19 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 118.529 -1.269 . . . . 0.0 114.081 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -142.38 153.81 44.09 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.58 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.064 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.37 144.83 30.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 118.978 0.808 . . . . 0.0 110.328 178.025 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.815 HD11 HD13 ' B' ' 31' ' ' ILE . 96.7 mt -94.06 104.51 16.54 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.229 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.616 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 45.0 t -88.92 120.36 37.5 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.487 HD12 ' HB3' ' B' ' 73' ' ' ASP . 9.4 mt -101.93 151.78 21.71 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.112 0.482 . . . . 0.0 111.791 -177.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.533 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.2 -7.55 54.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.611 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.3 -4.79 46.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.425 -1.262 . . . . 0.0 110.875 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.73 21.53 46.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . 0.487 ' HB3' HD12 ' B' ' 69' ' ' LEU . 20.1 t70 -126.02 160.92 28.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.446 -0.377 . . . . 0.0 110.222 -179.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.594 HG22 ' HA ' ' B' ' 68' ' ' VAL . 12.0 p -142.68 131.48 22.79 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.571 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 19.9 m -110.77 107.07 16.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.266 0.226 . . . . 0.0 110.434 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.29 151.18 26.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.517 . . . . 0.0 112.318 -178.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.829 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 35.9 m-85 -134.93 115.53 13.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.606 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.63 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.0 t-160 -87.35 100.91 13.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.887 -179.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.703 ' HZ ' HG21 ' B' ' 92' ' ' VAL . 22.9 m-85 -77.12 102.13 6.43 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.76 22.19 15.67 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.862 0.689 . . . . 0.0 112.862 -178.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.437 HD22 ' HA ' ' B' ' 81' ' ' ASN . 1.2 t-20 -89.45 97.06 10.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 110.292 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.09 -30.29 2.68 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.42 -59.53 2.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -178.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.482 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.0 p -127.38 11.05 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -175.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.643 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -45.63 -45.67 14.06 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.475 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.3 t -59.88 -52.67 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.803 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -67.52 -34.52 77.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.038 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.666 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.1 mt-10 -65.06 -45.61 84.59 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.569 ' HD2' ' HB ' ' B' ' 55' ' ' ILE . 24.7 ttp180 -54.06 -47.79 71.27 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 122.21 1.005 . . . . 0.0 108.398 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.27 -44.98 93.59 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.514 -1.675 . . . . 0.0 112.6 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.67 90.91 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.74 0.245 . . . . 0.0 111.154 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 1.049 HG13 HD11 ' B' ' 26' ' ' LEU . 42.9 t -60.87 -44.89 98.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -57.93 -54.65 44.51 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.063 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . 0.473 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 1.6 m-20 -55.37 -52.16 64.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.494 -1.23 . . . . 0.0 112.525 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.823 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -65.23 -28.42 69.35 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.822 -178.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 35.5 mt -78.47 -45.74 21.38 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.377 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' B' ' 94' ' ' ASP . 24.7 pt20 -63.14 -18.24 63.22 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.249 1.023 . . . . 0.0 109.156 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -88.47 -47.96 7.96 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.927 -1.488 . . . . 0.0 111.057 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.823 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -83.62 -41.31 17.97 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.751 HD22 ' HB ' ' B' ' 50' ' ' ILE . 35.7 mt -51.96 -50.85 76.01 Favored Pre-proline 0 CA--C 1.54 0.596 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.441 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 21.6 Cg_exo -66.08 -23.09 53.82 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.182 1.921 . . . . 0.0 115.146 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 11.0 pttp -72.49 1.81 7.41 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.941 -0.475 . . . . 0.0 112.096 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.944 ' HZ ' ' HA ' ' B' ' 29' ' ' GLU . 30.2 m-85 . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.384 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.539 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 3.8 pt-20 . . . . . 0 CA--C 1.515 -0.401 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.831 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -132.77 83.91 2.1 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.758 -178.612 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.493 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.7 p-10 -138.23 -47.37 0.52 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -73.81 12.28 0.7 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.513 0.673 . . . . 0.0 110.442 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.826 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -53.78 122.13 9.31 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.884 179.44 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.502 -0.898 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.0 mt -96.0 -30.39 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.092 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.463 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -132.92 122.73 24.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 80.3 mt -109.13 118.36 56.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.74 HG11 ' HE2' ' B' ' 79' ' ' PHE . 2.6 t -112.22 147.79 15.77 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.648 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.0 OUTLIER -109.22 -177.65 3.35 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 18.97 74.29 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 O-C-N 125.388 1.68 . . . . 0.0 112.883 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.648 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.8 t -124.44 122.59 64.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.314 179.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.627 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 7.3 mtp180 -96.25 130.98 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.353 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.613 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 0.7 OUTLIER -121.42 103.38 8.9 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.612 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp 59.15 64.89 1.29 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.179 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 68.93 22.89 6.9 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 176.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.655 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.9 pt20 -145.69 132.64 20.21 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.995 0.816 . . . . 0.0 110.858 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.41 ' CA ' ' HG2' ' B' ' 16' ' ' ARG . 1.6 t70 -86.23 153.76 21.78 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.07 -156.34 17.09 Favored Glycine 0 CA--C 1.522 0.516 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.756 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.31 135.11 54.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.882 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -100.69 140.85 34.38 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.481 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -135.96 109.83 8.17 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.817 0.342 . . . . 0.0 110.236 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.956 HD11 HG13 ' B' ' 92' ' ' VAL . 10.6 mt -89.0 120.84 30.78 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.53 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 36.5 mtt -102.24 161.56 13.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.043 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -28.82 57.86 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.927 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.92 -16.9 13.43 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ptp85 -158.91 162.01 36.84 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.796 -0.761 . . . . 0.0 112.822 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.898 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.07 114.81 41.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.741 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -113.56 150.36 33.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.976 0.417 . . . . 0.0 110.836 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.882 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.9 t90 -147.56 141.71 26.11 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.007 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -128.6 136.94 29.9 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.257 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.692 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 20.0 Cg_exo -64.75 158.22 51.83 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.566 2.177 . . . . 0.0 112.104 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -56.17 121.61 9.85 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.413 0.625 . . . . 0.0 112.099 -178.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.05 29.77 68.53 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.266 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.692 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.64 136.47 52.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.034 0.417 . . . . 0.0 110.358 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.4 -16.51 42.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.372 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -109.64 138.21 46.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.689 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -82.97 120.39 25.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.3 p -96.88 -6.49 35.71 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.089 0.471 . . . . 0.0 110.957 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.614 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 11.1 mm -119.88 117.32 53.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.079 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.6 t -147.9 101.33 3.29 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.438 ' CD2' HG23 ' B' ' 43' ' ' ILE . 69.9 m-70 -122.13 128.99 51.94 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.463 ' O ' HG12 ' B' ' 50' ' ' ILE . 65.4 mmm -80.04 141.11 36.18 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.574 ' HB3' ' HA ' ' B' ' 100' ' ' LEU . 23.1 m-85 -56.15 -24.77 43.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.941 0.4 . . . . 0.0 110.95 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.65 -29.18 65.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.121 -179.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.602 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -89.8 -4.82 57.44 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.188 0.518 . . . . 0.0 110.592 -179.041 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.569 HD13 HD22 ' B' ' 69' ' ' LEU . 4.4 mm -88.34 128.86 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.459 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -85.39 -43.73 13.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.558 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.613 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 6.7 p -161.6 -177.82 6.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.733 -178.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -142.22 143.59 32.96 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.963 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.041 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 27.6 mttp -112.92 153.44 27.98 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.599 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -132.2 125.48 54.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.691 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -89.41 115.53 64.0 Favored Pre-proline 0 C--O 1.249 1.051 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.28 172.57 7.42 Favored 'Trans proline' 0 CA--C 1.518 -0.297 0 C-N-CA 125.155 3.903 . . . . 0.0 114.68 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.68 158.87 17.35 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.441 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.58 -29.16 8.04 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 109.841 -1.303 . . . . 0.0 109.841 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.539 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 4.2 mttm -82.36 156.26 24.32 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 176.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.19 -18.5 61.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.64 0.733 . . . . 0.0 109.271 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.401 ' HB2' ' CD2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -134.41 119.63 18.81 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.104 -179.518 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.514 HG12 HG22 ' B' ' 86' ' ' VAL . 3.1 mp -72.74 134.57 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.474 HE21 ' HB2' ' B' ' 64' ' ' GLN . 11.0 mt-30 -137.5 163.32 31.43 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -176.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.484 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -138.11 153.15 49.28 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 175.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.041 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -144.96 138.49 26.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 119.505 1.048 . . . . 0.0 111.478 179.043 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.898 HD11 HD13 ' B' ' 31' ' ' ILE . 94.7 mt -94.21 105.96 17.94 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.853 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.613 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -91.54 111.78 24.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.569 HD22 HD13 ' B' ' 50' ' ' ILE . 2.3 mt -100.34 158.65 15.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -176.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.602 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -77.49 -6.98 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.208 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.87 -7.79 52.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.727 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.4 15.04 57.81 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.814 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -126.22 155.46 41.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.996 0.427 . . . . 0.0 110.954 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.558 HG22 ' HA ' ' B' ' 68' ' ' VAL . 24.3 p -129.96 131.46 45.96 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.009 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.544 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 4.3 m -105.82 105.08 14.95 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.485 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.831 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.6 m-20 -82.09 137.65 34.98 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.548 0.689 . . . . 0.0 111.811 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.612 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.3 m-85 -125.57 102.5 7.4 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 114.653 -1.158 . . . . 0.0 108.724 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.627 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.4 t-160 -86.84 117.13 25.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.206 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.74 ' HE2' HG11 ' B' ' 12' ' ' VAL . 70.7 m-85 -83.28 94.84 8.0 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.46 1.05 54.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' B' ' 85' ' ' ALA . 0.2 OUTLIER -78.17 91.08 4.3 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.038 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.57 -35.4 3.94 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 19.3 m -60.7 -60.71 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 17.9 p -128.23 15.73 6.69 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.474 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.68 -46.3 7.36 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.651 HG12 ' HD2' ' B' ' 87' ' ' LYS . 24.3 t -58.32 -53.09 51.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 0.0 111.574 -179.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.651 ' HD2' HG12 ' B' ' 86' ' ' VAL . 0.0 OUTLIER -75.7 -25.15 56.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.623 -178.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.607 ' O ' HG23 ' B' ' 92' ' ' VAL . 16.0 mt-10 -67.26 -40.32 86.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 176.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.532 ' NE ' HD12 ' B' ' 55' ' ' ILE . 18.5 ttp180 -59.44 -45.89 90.29 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . 0.639 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 83.6 m-20 -58.69 -48.34 81.42 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.78 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.09 -42.03 94.45 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.956 HG13 HD11 ' B' ' 26' ' ' LEU . 60.9 t -62.02 -43.39 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.639 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 11.1 ttpp -58.92 -51.93 67.93 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.942 177.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -58.75 -54.31 48.5 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.889 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.74 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.5 tp -59.61 -38.85 82.37 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.705 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.76 -42.67 70.15 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.7 -24.3 67.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 122.383 1.087 . . . . 0.0 109.008 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -85.9 -47.94 9.19 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.934 -1.485 . . . . 0.0 111.425 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.74 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -80.78 -43.02 20.79 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 115.189 1.552 . . . . 0.0 115.189 -176.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.642 ' HB2' ' HD3' ' B' ' 101' ' ' PRO . 24.7 mt -51.14 -59.89 6.76 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.642 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 29.6 Cg_exo -62.73 -16.07 50.75 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.012 1.808 . . . . 0.0 113.251 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.5 mtmm -78.69 -15.56 58.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 110.281 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 . . . . . 0 C--N 1.327 -0.402 0 CA-C-O 121.476 0.655 . . . . 0.0 109.548 179.177 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.534 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER . . . . . 0 CA--C 1.515 -0.373 0 CA-C-O 120.788 0.327 . . . . 0.0 110.572 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.445 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 0.6 OUTLIER -141.14 83.27 1.87 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.267 -179.345 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.556 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.2 p-10 -138.25 -46.67 0.52 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' B' ' 60' ' ' LYS . 2.3 p30 -72.97 11.58 0.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 122.047 0.927 . . . . 0.0 110.017 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.907 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -60.51 115.77 3.83 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.514 179.062 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 116.741 -0.208 . . . . 0.0 111.554 -178.532 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 62.9 t . . . . . 0 CA--C 1.516 -0.331 0 CA-C-O 121.094 0.473 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 27.9 mt -97.48 -31.83 12.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.93 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.2 tp -129.27 120.0 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.866 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.407 HG23 ' CE2' ' B' ' 25' ' ' TYR . 70.0 mt -103.9 120.93 54.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.939 -0.764 . . . . 0.0 108.939 177.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.833 HG21 HD23 ' B' ' 24' ' ' LEU . 3.3 t -111.27 149.31 14.06 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.383 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.576 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -113.86 179.32 3.99 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.543 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.499 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.48 72.04 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 O-C-N 125.328 1.642 . . . . 0.0 113.22 -178.155 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.576 HG23 ' O ' ' B' ' 13' ' ' LYS . 47.6 t -117.32 124.4 72.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.907 -1.042 . . . . 0.0 108.969 178.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.618 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.2 mtp180 -97.02 129.19 44.51 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.383 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.29 103.64 8.34 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.881 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.98 45.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.243 0 O-C-N 123.767 0.667 . . . . 0.0 110.65 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.423 ' HA ' ' CZ ' ' B' ' 16' ' ' ARG . 0.0 OUTLIER 67.13 23.4 9.58 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.792 179.59 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 2.9 tp-100 -123.67 119.43 29.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.605 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.78 153.32 27.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.189 0.519 . . . . 0.0 112.349 -177.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.02 -154.49 13.02 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.602 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.45 132.1 48.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.917 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.49 141.69 30.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . 0.407 ' CE2' HG23 ' B' ' 11' ' ' ILE . 37.4 m-85 -135.23 120.33 18.79 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.963 HD11 HG13 ' B' ' 92' ' ' VAL . 14.5 mt -99.94 116.24 31.53 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.03 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.8 mpt? -92.92 163.48 13.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.657 178.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.78 -39.9 62.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 58.5 mp0 -110.48 -5.04 15.23 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' B' ' 30' ' ' ARG . 14.4 ptt-85 -161.09 158.76 28.23 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.394 -0.922 . . . . 0.0 112.587 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.938 HD13 HD11 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.83 128.98 59.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.126 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.455 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -129.91 153.6 48.17 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.9 0.381 . . . . 0.0 110.509 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.917 ' HB2' HD12 ' B' ' 24' ' ' LEU . 36.5 t90 -147.01 141.8 26.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.451 ' HB2' ' HA ' ' B' ' 41' ' ' PHE . . . -128.25 143.91 49.81 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.866 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 34' ' ' ALA . 17.3 Cg_exo -65.48 153.01 80.14 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.699 2.266 . . . . 0.0 111.354 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -65.32 116.11 6.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.963 0.411 . . . . 0.0 110.21 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.25 8.75 54.75 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.301 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.905 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -105.04 144.8 31.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.689 0.757 . . . . 0.0 111.57 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.02 -22.31 27.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.172 -1.376 . . . . 0.0 111.523 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -122.13 150.29 42.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 0.0 111.611 -178.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.451 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 16.0 m-85 -79.9 143.4 34.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.17 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.1 -25.31 13.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.141 0.496 . . . . 0.0 110.476 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.838 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 16.3 mm -104.01 124.95 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.385 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.6 t -148.14 101.73 3.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.502 ' CD2' HG23 ' B' ' 43' ' ' ILE . 60.2 m-70 -130.25 138.43 50.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.528 ' O ' HG12 ' B' ' 50' ' ' ILE . 30.6 mtp -90.83 145.28 24.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.635 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.0 m-85 -57.84 -24.1 55.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.667 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.63 -26.2 64.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.876 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.54 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.96 -7.48 36.41 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.993 0.425 . . . . 0.0 110.735 -179.436 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.693 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -86.9 127.44 40.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.472 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 0.2 OUTLIER -81.38 -40.38 23.57 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.178 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.537 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 31.8 p -173.28 -177.84 1.6 Allowed 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.459 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . 0.571 HE22 HD11 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -137.71 139.34 40.11 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.909 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.058 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -102.76 151.4 22.44 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.573 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -128.03 128.98 69.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 175.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.414 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -90.05 114.08 59.56 Favored Pre-proline 0 C--O 1.249 1.068 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 64.4 Cg_endo -68.67 172.94 10.71 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 125.103 3.869 . . . . 0.0 114.492 -177.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -58.98 157.86 9.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.035 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.32 -29.03 8.21 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.534 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 4.1 mttm -85.28 160.09 19.92 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.1 -13.35 59.35 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.695 ' HB3' ' CD2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -131.72 127.75 37.49 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.568 -179.329 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.598 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -78.11 125.0 37.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 176.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -133.44 163.58 29.05 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -175.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.612 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -140.56 153.32 46.08 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 113.659 -1.609 . . . . 0.0 107.52 176.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.058 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.62 145.48 30.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 119.273 0.942 . . . . 0.0 111.141 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.938 HD11 HD13 ' B' ' 31' ' ' ILE . 73.1 mt -96.27 106.22 18.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.026 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.581 ' HA ' HG22 ' B' ' 74' ' ' THR . 10.6 t -93.25 121.87 44.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.491 HD22 HD13 ' B' ' 50' ' ' ILE . 4.3 mt -108.36 154.35 21.96 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -177.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.54 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.34 -5.73 46.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.747 0.784 . . . . 0.0 108.94 178.274 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.43 -4.11 43.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.559 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.57 21.04 55.19 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.371 -0.692 . . . . 0.0 111.371 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.05 157.3 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.514 -0.343 . . . . 0.0 110.533 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.581 HG22 ' HA ' ' B' ' 68' ' ' VAL . 19.8 p -139.86 131.03 26.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.548 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.3 102.68 11.78 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.464 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -82.36 139.14 34.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.338 0.589 . . . . 0.0 111.637 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.838 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 53.5 m-85 -129.53 110.92 12.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.012 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.695 ' CD2' ' HB3' ' B' ' 62' ' ' LYS . 5.3 t-160 -87.51 121.24 29.7 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.01 179.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.727 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 42.4 m-85 -85.03 93.6 8.63 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.5 13.68 25.22 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.499 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.0 OUTLIER -86.08 94.27 9.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.316 0.579 . . . . 0.0 110.513 179.47 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.74 -31.05 1.81 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.05 -59.52 2.7 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -178.191 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.509 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.3 p -127.32 14.16 7.16 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -176.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -45.36 -49.66 12.83 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 t -59.14 -51.4 73.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 110.876 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.509 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.6 mttt -66.38 -34.53 78.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.054 0.454 . . . . 0.0 109.979 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.613 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -65.84 -44.81 84.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.598 ' HD3' HG23 ' B' ' 63' ' ' ILE . 23.1 ttp180 -55.61 -45.33 77.51 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . 0.733 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -63.56 -45.79 88.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.733 -1.576 . . . . 0.0 112.519 179.676 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.22 81.85 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.924 0.329 . . . . 0.0 111.421 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.963 HG13 HD11 ' B' ' 26' ' ' LEU . 45.3 t -62.79 -39.38 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.733 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.6 OUTLIER -62.17 -56.89 14.18 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.563 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . 0.4 ' O ' ' HG2' ' B' ' 98' ' ' GLN . 1.6 m-20 -54.09 -53.89 46.93 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.801 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.732 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -61.64 -39.42 91.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.202 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.7 mt -69.47 -45.17 69.63 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 117.946 0.339 . . . . 0.0 110.366 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -64.24 -18.63 64.73 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.851 0.834 . . . . 0.0 109.475 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' B' ' 94' ' ' ASP . 27.9 mm-40 -85.88 -51.36 6.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.901 178.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.732 HD12 ' HG ' ' B' ' 95' ' ' LEU . 15.2 mt -76.0 -46.76 27.85 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.415 -1.721 . . . . 0.0 115.361 -176.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.693 HD22 ' HB ' ' B' ' 50' ' ' ILE . 31.5 mt -50.39 -60.15 5.85 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -61.74 -14.48 36.47 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.008 1.805 . . . . 0.0 113.146 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 20.3 mtmm -86.97 -14.51 41.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.17 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 . . . . . 0 C--N 1.331 -0.218 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.47 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.989 ' HG2' ' HE2' ' B' ' 62' ' ' LYS . 3.9 pt-20 . . . . . 0 CA--C 1.518 -0.276 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.906 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -143.55 84.53 1.8 Allowed 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.132 -0.627 . . . . 0.0 112.537 -177.244 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.519 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.7 p-10 -139.15 -45.67 0.47 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -72.37 11.06 0.65 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 110.271 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.923 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.02 112.55 1.55 Allowed 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.414 179.24 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 . . . . . 0 C--N 1.32 -0.71 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.411 -177.856 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 88.5 t . . . . . 0 CA--C 1.516 -0.336 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.533 HD12 HD11 ' B' ' 99' ' ' LEU . 22.7 mt -95.29 -29.01 14.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.264 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.454 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -137.4 137.3 38.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 75.5 mt -122.85 115.96 47.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.716 HG21 HD23 ' B' ' 24' ' ' LEU . 3.0 t -104.93 149.25 8.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.09 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.535 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.08 173.21 6.42 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.57 -179.177 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.59 ' HE3' ' HA ' ' B' ' 81' ' ' ASN . 22.1 mtmt 18.23 82.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 125.341 1.651 . . . . 0.0 113.471 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.535 HG23 ' O ' ' B' ' 13' ' ' LYS . 31.6 t -129.02 123.6 59.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.186 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.634 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 6.8 mtp-105 -98.61 141.27 31.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.213 0.53 . . . . 0.0 112.22 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -132.5 103.43 6.17 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 177.096 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 59.4 mttp 65.09 56.54 1.02 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.026 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? 68.83 23.93 6.69 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.155 177.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.554 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 10.4 tt0 -135.83 119.72 17.41 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.65 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -81.94 153.15 26.42 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.821 0.344 . . . . 0.0 111.72 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.672 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -177.38 -158.36 20.33 Favored Glycine 0 CA--C 1.521 0.433 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.186 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.42 136.83 54.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.126 0.488 . . . . 0.0 110.648 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.946 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.3 139.7 35.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.128 -178.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.45 125.72 29.63 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.899 HD11 HG13 ' B' ' 92' ' ' VAL . 16.9 mt -107.94 117.34 33.87 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.476 -0.489 . . . . 0.0 111.128 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -97.49 159.68 14.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.14 -27.83 55.64 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.101 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . 0.976 ' HA ' ' HE2' ' B' ' 103' ' ' PHE . 0.9 OUTLIER -103.07 -25.12 13.53 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.13 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . 0.492 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -157.97 169.86 23.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.915 -175.989 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.916 HD13 HD11 ' B' ' 67' ' ' LEU . 1.5 tt -110.79 122.14 64.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.661 178.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.459 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -123.17 149.82 44.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.011 0.434 . . . . 0.0 110.599 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.946 ' HB2' HD12 ' B' ' 24' ' ' LEU . 39.7 t90 -146.68 134.07 20.75 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.466 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -122.92 131.46 24.36 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.334 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.672 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 9.3 Cg_exo -70.3 160.0 51.08 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.536 2.157 . . . . 0.0 111.353 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 145.26 55.78 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.918 0.39 . . . . 0.0 109.972 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.35 24.87 74.93 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.555 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' B' ' 38' ' ' LYS . 25.3 mmtm -114.19 153.36 29.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.587 0.232 . . . . 0.0 110.579 179.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -106.39 5.02 29.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.556 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -151.73 160.18 43.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.24 -179.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -86.1 125.71 33.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.083 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 3.0 p -90.64 -22.48 21.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.29 0.567 . . . . 0.0 110.328 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.638 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 17.8 mm -107.46 118.62 55.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.111 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -147.93 101.58 3.31 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.477 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 59.1 m-70 -127.74 134.87 49.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.281 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.494 ' O ' HG12 ' B' ' 50' ' ' ILE . 84.0 mmm -84.79 143.07 29.35 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.708 ' HB2' ' HD2' ' B' ' 103' ' ' PHE . 22.7 m-30 -57.28 -22.69 43.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.83 0.348 . . . . 0.0 111.294 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.19 -26.87 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.893 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.617 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.6 OUTLIER -94.28 -4.21 49.19 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 110.6 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.619 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.7 mm -90.35 128.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.46 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 51.4 tttp -85.43 -40.68 16.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.396 0.617 . . . . 0.0 109.452 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.592 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.8 p -168.59 -177.62 3.18 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.291 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -143.06 139.57 30.56 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.313 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.942 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 53.2 mttp -106.99 161.44 14.72 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.668 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -133.07 130.15 57.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 175.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -91.27 118.0 68.2 Favored Pre-proline 0 C--O 1.25 1.086 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.66 173.08 11.4 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 124.966 3.778 . . . . 0.0 114.011 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -59.95 160.84 7.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.161 178.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.23 -28.76 8.09 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -177.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.553 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 14.5 mttp -89.52 158.29 17.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 176.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.96 -5.71 42.95 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.241 0.543 . . . . 0.0 110.485 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.989 ' HE2' ' HG2' ' A' ' 399' ' ' GLU . 0.7 OUTLIER -142.78 146.69 34.49 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.049 -179.558 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.697 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -90.61 131.47 37.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.53 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 24.5 mt-30 -131.9 163.16 28.93 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.526 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -140.82 153.45 45.8 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.417 -1.719 . . . . 0.0 106.642 175.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 0.942 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.47 142.39 28.05 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 119.149 0.886 . . . . 0.0 111.875 179.135 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.916 HD11 HD13 ' B' ' 31' ' ' ILE . 89.6 mt -94.33 104.49 16.47 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.928 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.664 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.1 t -90.14 114.39 27.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.548 HD22 HD13 ' B' ' 50' ' ' ILE . 4.0 mt -100.75 155.64 17.8 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -177.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.617 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -77.69 -3.46 41.23 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.279 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.94 -7.33 56.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.259 179.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.04 17.59 50.49 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.866 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -126.25 160.29 30.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.698 0.285 . . . . 0.0 110.8 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.664 HG22 ' HA ' ' B' ' 68' ' ' VAL . 21.2 p -137.71 131.73 31.79 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.552 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.4 m -106.48 109.57 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.41 0.148 . . . . 0.0 111.302 -179.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.906 HD21 ' HB3' ' A' ' 400' ' ' ASP . 5.6 m-20 -82.29 147.29 28.97 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.742 0.782 . . . . 0.0 112.19 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.638 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 43.1 m-85 -134.51 103.5 5.71 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.743 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.634 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.6 t-160 -86.46 107.78 18.22 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.513 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.672 ' CE2' HG11 ' B' ' 12' ' ' VAL . 54.2 m-85 -76.26 94.37 3.55 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.158 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.04 5.16 47.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.891 -178.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.59 ' HA ' ' HE3' ' B' ' 14' ' ' LYS . 46.4 t30 -85.98 91.13 8.29 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.448 ' CD ' ' H ' ' B' ' 82' ' ' GLU . 0.7 OUTLIER -51.66 -29.09 16.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.543 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 2.1 m -60.13 -60.21 4.18 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.512 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.9 p -128.34 12.76 6.54 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.55 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.7 -50.04 7.68 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.417 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -58.34 -52.44 59.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.848 0.356 . . . . 0.0 110.869 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.512 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.4 mttt -66.4 -37.33 84.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.052 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.686 ' O ' HG23 ' B' ' 92' ' ' VAL . 13.8 mt-10 -63.95 -43.55 95.49 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.697 ' HD3' HG23 ' B' ' 63' ' ' ILE . 28.4 ttp180 -56.63 -49.67 74.29 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . 0.541 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -59.85 -43.3 94.7 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.635 -1.62 . . . . 0.0 112.225 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -43.47 74.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.675 0.216 . . . . 0.0 111.27 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.899 HG13 HD11 ' B' ' 26' ' ' LEU . 40.2 t -61.02 -42.72 94.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.668 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.3 tmmt? -59.34 -58.66 7.65 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.722 178.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.31 -53.91 44.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.158 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.549 ' HG ' ' CD1' ' B' ' 99' ' ' LEU . 10.7 tp -62.12 -37.13 83.95 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.182 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.456 HD12 HG12 ' B' ' 92' ' ' VAL . 26.0 mt -73.34 -41.01 63.97 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.7 -19.96 59.93 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.197 0.998 . . . . 0.0 108.971 178.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -93.86 -51.9 4.68 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.813 -1.54 . . . . 0.0 111.043 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.657 ' HB3' ' CE1' ' B' ' 47' ' ' TYR . 42.4 mt -75.75 -28.41 58.48 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.494 -1.685 . . . . 0.0 115.432 -176.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.619 HD22 ' HB ' ' B' ' 50' ' ' ILE . 36.4 mt -72.5 -58.18 3.08 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 18.6 Cg_endo -57.59 -19.18 35.98 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.542 2.162 . . . . 0.0 114.178 -177.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 17.9 pttm -80.5 -11.98 59.6 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.172 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.976 ' HE2' ' HA ' ' B' ' 29' ' ' GLU . 17.5 m-30 . . . . . 0 N--CA 1.466 0.357 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.772 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.879 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 57.7 tt0 . . . . . 0 CA--C 1.514 -0.421 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.607 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.2 OUTLIER -135.94 91.27 2.67 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.09 -45.22 0.47 Allowed 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -72.05 8.22 1.35 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.269 0.557 . . . . 0.0 110.774 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.994 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -52.99 120.05 5.39 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.75 179.426 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.352 -178.026 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t . . . . . 0 N--CA 1.451 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.3 mt -95.67 -31.66 13.14 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.301 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.457 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -131.37 129.3 41.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.923 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.1 mt -113.82 122.68 68.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.859 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.6 t -113.59 150.27 15.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.634 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.7 mtmp? -116.67 178.6 4.28 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.441 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 1.2 mmtm 18.45 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 O-C-N 125.2 1.562 . . . . 0.0 113.422 -178.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.634 HG23 ' O ' ' B' ' 13' ' ' LYS . 24.7 t -124.01 125.11 70.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.139 179.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.644 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.8 mpt_? -93.75 132.78 37.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.92 0.39 . . . . 0.0 110.629 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.416 ' HG3' HG13 ' B' ' 43' ' ' ILE . 5.2 tm0? -129.59 113.74 15.19 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.475 ' HD3' ' HA ' ' B' ' 18' ' ' LYS . 0.5 OUTLIER 66.4 41.03 3.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.952 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? 68.52 29.94 5.4 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.051 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.6 tp-100 -131.23 126.64 36.02 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.533 ' CG ' ' HE ' ' B' ' 16' ' ' ARG . 9.3 t0 -73.95 146.57 43.8 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.634 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -179.1 -164.69 32.18 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.656 -0.783 . . . . 0.0 113.84 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.46 136.6 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.182 0.593 . . . . 0.0 109.43 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.932 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -99.13 143.64 29.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.993 -178.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -137.57 115.56 11.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.82 0.343 . . . . 0.0 110.173 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.96 HD11 HG13 ' B' ' 92' ' ' VAL . 13.0 mt -94.25 128.41 40.69 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.772 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 18.8 mtt -106.44 167.98 9.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.775 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.87 65.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -176.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -121.67 4.31 10.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . 0.46 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.2 OUTLIER -157.84 156.59 31.71 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 119.29 -0.964 . . . . 0.0 112.68 -177.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.973 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -109.08 120.86 61.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 108.592 178.449 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.446 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.04 150.57 40.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.495 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.932 ' HB2' HD12 ' B' ' 24' ' ' LEU . 29.7 t90 -147.12 135.53 21.79 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.44 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -123.74 134.41 25.29 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.137 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 1.051 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -72.48 144.93 41.47 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 122.314 2.01 . . . . 0.0 111.591 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.491 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 32.2 mt-10 -64.45 129.24 39.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.157 0.503 . . . . 0.0 110.648 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.5 1.38 64.17 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.05 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 1.051 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.0 mptt -113.34 151.64 30.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.632 0.253 . . . . 0.0 110.327 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -100.15 8.09 44.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.887 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -138.97 151.67 47.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.131 0.491 . . . . 0.0 112.077 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 65.2 m-85 -86.0 121.36 28.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.585 179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -16.12 29.24 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.232 0.539 . . . . 0.0 110.529 179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.669 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 18.9 mm -113.65 118.91 59.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.752 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.3 t -148.03 101.21 3.27 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.483 ' CD2' HG23 ' B' ' 43' ' ' ILE . 54.5 m-70 -128.12 138.58 52.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.537 ' O ' HG12 ' B' ' 50' ' ' ILE . 61.6 mmm -88.33 143.64 26.89 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.2 m-85 -59.84 -21.71 61.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 110.305 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.15 -15.3 61.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.482 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.574 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.33 -10.48 18.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.29 0.567 . . . . 0.0 109.52 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.691 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.6 mm -90.31 126.29 43.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.445 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 0.1 OUTLIER -86.67 -41.0 14.56 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.286 0.565 . . . . 0.0 110.063 -179.085 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.635 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -160.71 -177.83 6.44 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.574 -179.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.48 140.47 26.25 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.798 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.046 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.7 mttp -105.15 156.85 17.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.743 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -132.08 126.85 57.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.414 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -90.52 118.88 69.06 Favored Pre-proline 0 C--O 1.247 0.935 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.54 172.8 11.78 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 124.67 3.58 . . . . 0.0 114.34 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -60.79 160.99 8.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.326 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.52 -29.19 7.72 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -177.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.879 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.4 mttp -89.03 146.69 24.69 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 175.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.73 -4.22 18.82 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.359 0.599 . . . . 0.0 110.392 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.706 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 16.1 pttm -139.54 125.6 19.87 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.181 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mp -78.21 137.69 21.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -136.4 163.2 31.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.578 HD13 ' HG2' ' B' ' 89' ' ' ARG . 1.1 tp -141.66 153.44 44.72 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.442 177.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.046 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.29 143.62 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 178.65 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.973 HD11 HD13 ' B' ' 31' ' ' ILE . 97.1 mt -97.62 106.01 18.25 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.969 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.635 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 18.5 t -90.35 111.82 23.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.483 HD22 HD13 ' B' ' 50' ' ' ILE . 6.6 mt -93.98 156.5 16.58 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.081 0.467 . . . . 0.0 112.203 -177.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.574 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.66 -3.45 44.11 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.247 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.26 -4.59 53.86 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.578 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.36 19.98 53.42 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -126.09 158.23 35.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.564 -0.318 . . . . 0.0 110.406 -179.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.609 HG22 ' HA ' ' B' ' 68' ' ' VAL . 16.6 p -136.0 131.53 35.13 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.564 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.6 m -107.23 108.47 19.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.188 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.607 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.8 m-20 -82.13 154.66 25.42 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.291 0.567 . . . . 0.0 112.001 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.669 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.3 m-85 -140.5 111.39 6.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.979 -1.009 . . . . 0.0 109.511 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.644 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.2 t-160 -88.56 104.84 17.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.607 -179.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.649 ' HZ ' HG21 ' B' ' 92' ' ' VAL . 41.6 m-85 -80.43 108.98 14.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 4.4 p -116.7 5.87 13.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.488 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -77.8 91.62 4.13 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.807 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.55 -38.64 1.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.966 0.906 . . . . 0.0 113.367 -178.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -58.26 -59.66 4.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.537 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.82 9.01 6.35 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -176.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.466 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.52 -48.3 7.38 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -177.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.43 -52.61 58.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.824 0.345 . . . . 0.0 110.644 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.537 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.4 mttt -67.01 -32.67 74.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.152 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.656 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.5 mt-10 -65.46 -46.12 81.07 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.633 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 4.1 tmm_? -57.94 -40.78 81.34 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . 0.538 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 1.6 m-20 -64.91 -47.36 78.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.016 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.35 -43.57 81.17 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.96 HG13 HD11 ' B' ' 26' ' ' LEU . 41.5 t -61.0 -41.17 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 177.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.743 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.5 tmmt? -61.32 -57.25 13.1 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.414 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -55.8 15.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.143 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.811 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.1 tp -62.04 -31.19 71.57 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.568 -178.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 23.0 mt -78.63 -43.99 24.95 Favored 'General case' 0 C--O 1.218 -0.6 0 O-C-N 122.219 -0.301 . . . . 0.0 110.749 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' B' ' 93' ' ' LYS . 21.0 mt-30 -65.56 -17.85 64.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.098 0.951 . . . . 0.0 108.87 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -87.61 -49.56 7.09 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.63 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.811 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.4 mt -81.49 -33.49 31.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 115.401 1.63 . . . . 0.0 115.401 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.718 HD23 ' HB3' ' B' ' 47' ' ' TYR . 58.8 mt -66.82 -57.27 11.95 Favored Pre-proline 0 C--N 1.317 -0.814 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.637 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 39.4 Cg_exo -58.73 -20.62 52.13 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.399 2.066 . . . . 0.0 114.211 -178.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.673 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 7.2 ptmm? -81.77 -19.72 40.7 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.537 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.445 ' HD1' ' HB2' ' B' ' 47' ' ' TYR . 24.0 m-85 . . . . . 0 C--N 1.33 -0.252 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.428 179.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.842 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.5 mt-10 . . . . . 0 CA--C 1.514 -0.414 0 CA-C-O 120.726 0.298 . . . . 0.0 111.799 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.885 ' HB3' HD21 ' B' ' 76' ' ' ASN . 9.6 p-10 177.86 77.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.643 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.49 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.98 -51.19 0.6 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.412 -0.805 . . . . 0.0 112.964 -178.256 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.53 9.85 0.97 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.315 0.579 . . . . 0.0 110.331 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.912 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -51.92 127.3 20.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.183 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 . . . . . 0 C--N 1.318 -0.776 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.85 -179.39 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 45.5 t . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.71 -29.56 25.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.617 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.439 HD23 ' HG ' ' B' ' 26' ' ' LEU . 7.2 tp -136.12 132.76 36.5 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 60.3 mt -117.2 120.79 66.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.803 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.9 t -112.75 148.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.406 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.593 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.47 175.95 5.26 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.285 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.566 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.17 78.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 O-C-N 125.422 1.701 . . . . 0.0 113.667 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.593 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.8 t -129.04 125.54 62.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.798 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.629 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 38.6 mtp180 -99.68 138.2 37.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.245 0.545 . . . . 0.0 111.502 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.416 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -124.92 114.27 18.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 176.714 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 0.0 OUTLIER 68.64 31.34 4.68 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 76.24 13.06 2.63 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 114.343 -1.298 . . . . 0.0 112.148 -179.763 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.629 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 5.7 tp-100 -105.85 118.9 37.79 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -77.27 149.98 35.36 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 -177.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.731 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -178.39 -155.39 14.3 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.817 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.85 137.6 51.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.139 0.495 . . . . 0.0 110.156 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 1.0 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.47 138.97 34.09 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.006 -178.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -134.06 110.14 9.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.68 0.276 . . . . 0.0 110.338 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.92 HD11 HG13 ' B' ' 92' ' ' VAL . 10.8 mt -87.71 129.0 35.3 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.069 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 21.7 mtt -109.27 169.1 8.91 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.968 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.88 -50.61 14.22 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -115.29 6.53 14.96 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -158.42 157.6 32.58 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 119.532 -0.867 . . . . 0.0 112.86 -178.083 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.87 HD13 HD11 ' B' ' 67' ' ' LEU . 1.3 tt -106.77 116.47 50.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 178.049 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -117.97 151.75 36.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.988 0.423 . . . . 0.0 111.044 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 1.0 ' HB2' HD12 ' B' ' 24' ' ' LEU . 47.4 t90 -147.14 136.41 22.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.873 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.47 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -125.73 133.22 24.69 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.382 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 1.001 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 5.6 Cg_exo -74.81 148.68 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.596 2.197 . . . . 0.0 111.62 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.572 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 73.5 mt-10 -65.54 130.86 44.8 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.102 0.477 . . . . 0.0 110.829 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.03 2.19 62.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.129 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 1.001 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 4.3 mptt -113.28 148.89 34.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.691 0.281 . . . . 0.0 110.337 179.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -98.06 5.86 48.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.603 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -141.34 152.83 44.74 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.158 0.504 . . . . 0.0 111.844 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -82.98 122.87 28.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.902 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -90.87 -18.61 24.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.31 0.576 . . . . 0.0 110.532 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.626 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 18.1 mm -112.49 117.84 56.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.392 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 25.9 t -148.06 101.46 3.29 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.464 ' CD2' HG23 ' B' ' 43' ' ' ILE . 48.8 m-70 -125.11 138.04 54.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.986 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.504 ' O ' HG12 ' B' ' 50' ' ' ILE . 67.5 mmm -87.94 143.54 27.05 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.5 m-85 -58.73 -21.86 56.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.907 0.384 . . . . 0.0 110.516 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.91 -13.1 60.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.679 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.599 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.4 -10.67 16.83 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.321 0.582 . . . . 0.0 109.586 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.618 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.6 mm -89.37 127.21 42.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.445 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 21.9 tttp -84.8 -44.53 13.19 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.459 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -161.29 -178.03 6.42 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.052 -0.976 . . . . 0.0 108.731 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -144.49 142.15 30.06 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.259 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.133 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 28.6 mttp -108.61 155.26 20.88 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.704 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.51 127.65 62.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 176.447 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.432 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -90.64 116.91 67.46 Favored Pre-proline 0 C--O 1.249 1.029 0 C-N-CA 120.016 -0.674 . . . . 0.0 109.432 -179.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 73.6 Cg_endo -69.36 173.37 10.72 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 125.24 3.96 . . . . 0.0 113.767 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -58.38 160.33 5.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.647 -1.16 . . . . 0.0 110.092 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.2 7.87 Favored Glycine 0 C--N 1.315 -0.605 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.776 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 6.7 mttm -88.66 152.92 21.51 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.4 -9.11 55.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.335 0.588 . . . . 0.0 110.456 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.842 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.65 141.98 37.02 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.689 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.693 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -83.85 130.19 36.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.478 HE21 ' HB2' ' B' ' 64' ' ' GLN . 3.6 mt-30 -132.05 162.78 29.94 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 118.805 -1.158 . . . . 0.0 113.851 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.432 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 2.0 tp -139.91 153.56 47.0 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.851 -1.522 . . . . 0.0 107.272 177.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.133 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.97 138.21 25.35 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.311 178.869 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.87 HD11 HD13 ' B' ' 31' ' ' ILE . 71.8 mt -94.17 104.94 16.94 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.501 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.736 ' HA ' HG22 ' B' ' 74' ' ' THR . 10.7 t -89.09 109.07 19.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.532 HD22 HD13 ' B' ' 50' ' ' ILE . 2.3 mt -93.82 157.26 16.22 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.985 -177.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -81.31 1.04 34.39 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.232 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -16.17 59.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.548 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 104.25 7.59 40.15 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.939 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . 0.498 ' OD1' HD12 ' B' ' 69' ' ' LEU . 8.7 p-10 -126.37 170.42 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.206 0.527 . . . . 0.0 111.859 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.736 HG22 ' HA ' ' B' ' 68' ' ' VAL . 8.8 p -137.57 131.93 32.39 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.763 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 9.6 m -103.98 112.56 25.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.73 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.885 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.8 m-20 -84.51 153.87 23.04 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.628 0.728 . . . . 0.0 112.164 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.572 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 36.7 m-85 -133.62 111.86 10.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.573 178.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.556 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t60 -86.59 98.97 11.38 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.701 -177.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.805 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 41.8 m-85 -77.06 95.57 4.23 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.42 4.97 44.2 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.566 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -80.3 91.35 5.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.125 0.488 . . . . 0.0 110.297 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.18 -42.1 4.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.325 -0.852 . . . . 0.0 113.173 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -59.75 4.72 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 18.1 p -127.62 8.75 6.43 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.805 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.75 -47.93 7.99 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -178.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.436 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.11 -52.03 65.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.845 0.355 . . . . 0.0 111.016 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.575 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 6.4 mptt -67.67 -35.09 78.21 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.036 0.446 . . . . 0.0 109.817 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.672 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -64.75 -44.79 88.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.693 ' HD3' HG23 ' B' ' 63' ' ' ILE . 28.3 ttp180 -54.55 -47.64 72.97 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . 0.673 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -61.94 -44.86 95.9 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.293 179.687 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.39 -41.43 80.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 117.79 0.268 . . . . 0.0 111.406 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.92 HG13 HD11 ' B' ' 26' ' ' LEU . 41.1 t -62.42 -42.23 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 177.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.704 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.1 tmmt? -59.43 -56.97 15.26 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.436 177.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.92 -52.99 58.83 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.148 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.777 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.9 tp -61.19 -42.77 99.17 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.038 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.418 HD12 HG12 ' B' ' 92' ' ' VAL . 21.2 mt -68.01 -43.89 77.8 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.18 -24.1 66.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.066 0.936 . . . . 0.0 109.381 178.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -84.9 -49.98 7.91 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.326 -1.306 . . . . 0.0 110.74 178.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.777 HD12 ' HG ' ' B' ' 95' ' ' LEU . 11.9 mt -77.09 -47.28 20.92 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 113.574 -1.648 . . . . 0.0 115.257 -176.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.718 HD23 ' HB3' ' B' ' 47' ' ' TYR . 33.0 mt -50.19 -54.8 30.04 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -176.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 25.9 Cg_endo -60.64 -16.49 43.44 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.091 1.861 . . . . 0.0 113.337 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -87.77 -8.73 55.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.269 179.942 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.975 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.3 tt0 . . . . . 0 CA--C 1.514 -0.41 0 CA-C-O 120.858 0.361 . . . . 0.0 111.304 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.646 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 13.1 p-10 -136.59 93.21 2.84 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.753 0.787 . . . . 0.0 111.803 -178.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.521 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.2 p-10 -139.29 -44.72 0.46 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 16.2 p30 -74.41 12.8 0.69 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.718 0.77 . . . . 0.0 110.103 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.756 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -55.29 121.54 9.13 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.673 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 C--N 1.314 -0.94 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.426 -178.344 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 120.826 0.346 . . . . 0.0 110.289 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 82.4 mt -87.16 -31.93 20.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.711 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.422 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -138.53 134.5 33.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.402 HG23 ' CE1' ' B' ' 25' ' ' TYR . 68.3 mt -117.61 124.18 72.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.753 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.2 t -115.65 149.96 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.652 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.643 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -111.17 179.3 4.08 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.43 -178.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.542 ' H ' ' HD2' ' B' ' 14' ' ' LYS . 1.3 mptp? 18.55 70.63 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 O-C-N 124.978 1.424 . . . . 0.0 113.939 -179.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.668 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.0 t -123.39 120.35 59.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.151 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.541 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 3.2 mtm180 -92.38 142.39 27.49 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.198 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.58 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.33 105.38 5.21 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.17 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 mptt 71.91 49.24 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.887 0.742 . . . . 0.0 110.818 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 7.9 mptt 70.6 27.66 3.72 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.658 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.8 pt20 -145.98 132.46 19.73 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.911 -0.493 . . . . 0.0 110.649 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -80.06 153.17 28.95 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.967 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.525 ' HA2' ' H ' ' B' ' 36' ' ' GLU . . . -178.09 -162.67 28.35 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.239 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.99 137.44 54.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.062 0.458 . . . . 0.0 109.863 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.917 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.3 tp -98.01 141.51 30.88 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.24 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . 0.402 ' CE1' HG23 ' B' ' 11' ' ' ILE . 34.5 m-85 -136.57 113.7 10.61 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.796 HD11 HG13 ' B' ' 92' ' ' VAL . 14.7 mt -90.53 130.99 36.52 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.34 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 15.0 mtt -112.13 159.89 18.09 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.03 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.3 -40.31 5.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -119.53 -4.44 10.34 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 27.2 ptt180 -151.72 158.63 43.64 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.534 -177.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 1.016 HD13 HD11 ' B' ' 67' ' ' LEU . 1.7 tt -107.83 120.49 59.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -120.26 146.85 45.67 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.001 0.429 . . . . 0.0 110.694 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.917 ' HB2' HD12 ' B' ' 24' ' ' LEU . 24.1 t90 -146.83 140.07 25.48 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.574 ' HB2' ' HA ' ' B' ' 41' ' ' PHE . . . -133.93 141.05 38.3 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.798 -179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.507 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 14.3 Cg_exo -65.94 141.51 64.96 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.383 2.055 . . . . 0.0 110.522 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.525 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 4.4 mt-10 -64.57 116.0 5.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.318 0.58 . . . . 0.0 109.589 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 109.61 3.29 30.62 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.569 ' HA ' ' NZ ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -107.14 148.5 28.75 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.403 0.62 . . . . 0.0 111.306 179.467 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -93.32 -22.35 19.02 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.473 -1.24 . . . . 0.0 111.828 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.1 133.77 55.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.73 0.3 . . . . 0.0 111.174 -178.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.574 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 75.2 m-85 -68.66 120.98 15.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . 0.437 ' OG1' ' HD3' ' B' ' 35' ' ' PRO . 0.8 OUTLIER -79.91 -39.33 30.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.023 0.44 . . . . 0.0 110.638 -179.799 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.65 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 17.6 mm -93.08 119.12 40.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.954 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -147.95 101.22 3.28 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.472 ' CD2' HG23 ' B' ' 43' ' ' ILE . 52.3 m-70 -132.05 143.32 49.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.935 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.4 ' O ' HG12 ' B' ' 50' ' ' ILE . 5.9 mtp -91.36 145.16 24.87 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.742 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.51 -21.69 39.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.045 0.45 . . . . 0.0 110.413 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.65 -10.7 59.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.992 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.593 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.01 -4.59 17.69 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.315 0.578 . . . . 0.0 109.831 179.624 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.702 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.7 mm -90.3 132.84 33.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.541 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 17.7 ttpt -88.86 -41.84 12.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.274 0.559 . . . . 0.0 109.713 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.734 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 24.3 p -162.35 -178.0 6.03 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.403 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -146.73 139.24 25.01 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.741 0.305 . . . . 0.0 110.853 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.049 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 19.0 mttp -109.58 156.5 20.1 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.545 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.37 128.09 63.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 176.048 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -89.03 118.92 69.68 Favored Pre-proline 0 C--O 1.249 1.036 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.32 173.18 13.49 Favored 'Trans proline' 0 C--O 1.234 0.316 1 C-N-CA 125.311 4.008 . . . . 0.0 114.559 -177.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -60.21 160.98 7.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.201 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.31 -29.14 7.82 Favored Glycine 0 C--N 1.316 -0.53 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.975 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 10.0 mttp -90.7 154.0 19.87 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 2.76 8.49 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.236 0.541 . . . . 0.0 110.502 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.23 148.04 32.08 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.526 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.636 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -96.86 136.54 27.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.405 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 10.5 mt-30 -138.7 163.24 32.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.585 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.6 153.59 47.4 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 113.812 -1.54 . . . . 0.0 106.862 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.049 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -145.99 134.49 22.03 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 119.302 0.955 . . . . 0.0 111.266 178.845 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 1.016 HD11 HD13 ' B' ' 31' ' ' ILE . 26.0 mt -94.15 104.15 16.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.768 178.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.734 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -88.62 103.73 14.1 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.592 HD22 HD13 ' B' ' 50' ' ' ILE . 2.4 mt -89.25 157.86 18.07 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.05 -177.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.593 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.3 0.27 37.77 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.018 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.79 -10.16 59.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.15 11.57 54.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.002 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -126.41 154.72 43.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.563 HG22 ' HA ' ' B' ' 68' ' ' VAL . 13.7 p -124.11 131.01 53.5 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.584 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 1.4 m -103.64 98.63 8.48 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.535 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 4.8 m-20 -85.74 122.36 29.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.404 0.621 . . . . 0.0 111.885 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.632 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 63.0 m-85 -103.81 113.37 26.85 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.008 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.668 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.9 t60 -86.59 100.0 12.11 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.041 -178.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.684 ' CE1' HG11 ' B' ' 12' ' ' VAL . 54.8 m-85 -76.84 88.18 3.44 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.09 13.09 35.69 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.536 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.8 t-20 -83.22 92.94 7.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.318 0.58 . . . . 0.0 109.933 179.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.06 -34.9 0.79 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.84 -59.57 3.42 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -178.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.514 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -127.36 11.6 6.92 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -176.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.9 -47.87 11.24 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.96 -52.1 65.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.887 0.375 . . . . 0.0 110.817 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.514 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.8 mttt -66.6 -34.11 77.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.922 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.63 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.1 mt-10 -65.71 -44.44 86.08 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.636 ' HD3' HG23 ' B' ' 63' ' ' ILE . 26.2 ttp180 -56.29 -47.86 77.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . 0.545 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.43 -44.38 96.55 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 113.865 -1.516 . . . . 0.0 112.381 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.14 -44.46 79.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.767 0.258 . . . . 0.0 111.312 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.796 HG13 HD11 ' B' ' 26' ' ' LEU . 48.9 t -60.33 -44.09 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.545 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.1 tmmt? -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.724 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -55.53 25.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.895 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.683 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.4 tp -63.26 -32.56 74.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.139 -179.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.515 HD12 HG12 ' B' ' 92' ' ' VAL . 20.9 mt -76.36 -39.26 54.32 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -66.08 -18.58 65.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.289 1.042 . . . . 0.0 108.621 178.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -87.88 -48.4 7.84 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.521 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.683 HD12 ' HG ' ' B' ' 95' ' ' LEU . 16.3 mt -82.8 -37.32 24.68 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 -176.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.742 HD23 ' HB3' ' B' ' 47' ' ' TYR . 66.4 mt -63.48 -58.44 15.48 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.689 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 37.7 Cg_exo -58.57 -23.49 65.23 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.245 1.964 . . . . 0.0 113.499 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.526 ' HG2' ' HA ' ' B' ' 99' ' ' LEU . 2.3 ptmm? -88.15 1.37 54.52 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.467 ' HD1' ' O ' ' B' ' 99' ' ' LEU . 21.6 m-85 . . . . . 0 C--N 1.33 -0.262 0 CA-C-O 120.705 0.288 . . . . 0.0 111.132 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.945 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.7 tt0 . . . . . 0 CA--C 1.513 -0.466 0 CA-C-O 120.92 0.39 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.611 ' HB2' ' CE2' ' A' ' 403' ' ' PHE . 11.8 p-10 -134.0 94.46 3.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.76 0.79 . . . . 0.0 111.857 -178.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.496 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.42 -46.98 0.46 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -73.31 12.09 0.64 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.377 0.608 . . . . 0.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 0.674 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -53.29 115.96 2.17 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.596 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.321 -0.66 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 90.9 t . . . . . 0 CA--C 1.516 -0.342 0 CA-C-O 121.371 0.605 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.508 ' HB2' HD21 ' B' ' 95' ' ' LEU . 23.4 mt -97.79 -31.61 12.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.34 179.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.3 tp -132.97 137.8 46.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.8 mt -122.34 121.59 64.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.737 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.5 t -110.6 148.67 13.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.136 -179.373 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.559 ' HD3' ' N ' ' B' ' 13' ' ' LYS . 0.1 OUTLIER -108.3 174.09 6.03 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.673 -178.78 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 18.0 70.05 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 O-C-N 125.084 1.49 . . . . 0.0 114.27 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.558 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.1 t -116.21 120.98 66.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.612 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 31.9 mtp180 -96.7 119.85 35.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.154 0.502 . . . . 0.0 110.953 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' B' ' 76' ' ' ASN . 10.7 tm0? -109.98 119.84 40.58 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.601 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 65.56 33.52 8.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -178.262 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.35 18.65 7.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.332 -1.304 . . . . 0.0 111.552 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tp-100 -110.12 119.1 38.21 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.33 144.4 56.59 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.741 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . -178.92 -165.94 34.12 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.409 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.59 136.81 53.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.071 0.462 . . . . 0.0 109.897 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.948 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.81 142.22 29.84 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.4 -177.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -135.03 124.16 24.38 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.845 HD11 HG13 ' B' ' 92' ' ' VAL . 19.3 mt -105.3 121.11 43.19 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.643 -178.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -97.88 159.13 15.13 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.79 -21.54 56.27 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -116.87 -16.85 10.55 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -154.84 164.73 38.4 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.374 -176.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 1.005 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -114.32 122.55 68.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.233 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -125.45 152.55 44.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.033 0.444 . . . . 0.0 110.512 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.948 ' HB2' HD12 ' B' ' 24' ' ' LEU . 21.9 t90 -146.87 136.81 23.3 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.453 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -122.38 135.35 25.46 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.185 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 1.081 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 4.8 Cg_exo -72.08 150.09 53.57 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.54 2.16 . . . . 0.0 111.803 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.741 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.1 mt-10 -63.66 124.41 21.36 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.928 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.59 6.47 62.43 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 1.081 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 10.0 mptt -113.32 149.71 33.57 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -97.06 -1.39 45.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.888 -178.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -132.63 151.07 52.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.169 0.509 . . . . 0.0 112.055 -178.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.422 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 44.1 m-85 -83.88 121.26 27.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.678 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.1 p -87.53 -21.85 25.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.208 0.528 . . . . 0.0 110.487 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.608 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 11.5 mm -102.39 122.98 55.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.23 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.3 t -147.68 101.56 3.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.183 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.503 ' CD2' HG23 ' B' ' 43' ' ' ILE . 51.0 m-70 -133.99 139.44 46.06 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.473 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.4 mtp -96.94 148.68 22.71 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.659 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.4 m-85 -58.18 -23.2 54.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.853 0.359 . . . . 0.0 111.287 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.99 -25.28 62.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.053 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.599 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -97.15 -4.76 38.66 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.823 0.344 . . . . 0.0 110.833 -179.614 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.564 HD13 HD22 ' B' ' 69' ' ' LEU . 4.1 mm -83.45 131.48 33.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.458 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 13.7 tttm -91.94 -37.19 13.01 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.73 0.3 . . . . 0.0 110.352 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.588 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.6 p -169.39 179.97 3.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -139.83 143.83 37.0 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.271 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.125 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 16.9 mttm -115.3 150.1 36.78 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.526 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -130.57 129.25 64.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.653 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.471 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -91.34 121.15 67.99 Favored Pre-proline 0 C--O 1.249 1.028 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.283 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -72.56 173.44 13.27 Favored 'Trans proline' 0 C--O 1.234 0.318 1 C-N-CA 125.586 4.191 . . . . 0.0 114.733 -177.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -58.67 160.64 5.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.407 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.92 -29.01 8.03 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 -178.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.945 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.9 mttp -89.81 154.62 19.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.3 -11.85 61.18 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.216 0.532 . . . . 0.0 110.299 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.659 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.15 140.84 40.04 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.769 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.57 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.3 mp -85.21 140.3 16.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . 0.471 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 18.8 mt-30 -139.94 163.18 33.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.473 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.3 tp -142.54 153.54 43.67 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.339 176.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.125 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 137.22 23.73 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 119.241 0.928 . . . . 0.0 110.939 178.281 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 1.005 HD11 HD13 ' B' ' 31' ' ' ILE . 96.4 mt -94.14 104.09 16.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.869 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.588 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 5.7 t -88.59 110.78 21.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.564 HD22 HD13 ' B' ' 50' ' ' ILE . 4.4 mt -97.57 155.9 16.76 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.6 OUTLIER -81.67 2.95 27.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.013 178.218 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.85 -5.83 59.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.157 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.31 16.14 53.94 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.547 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -126.12 154.3 43.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.759 0.314 . . . . 0.0 110.775 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.549 HG22 ' HA ' ' B' ' 68' ' ' VAL . 17.0 p -130.23 130.71 44.95 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.59 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.2 m -106.56 98.98 8.58 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.62 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.494 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 5.3 m-20 -82.41 147.09 28.97 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.848 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.51 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 59.2 m-85 -131.24 112.71 13.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.834 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.612 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.7 t-160 -87.03 99.91 12.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.285 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.692 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 43.1 m-85 -75.07 100.02 4.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.53 11.4 28.76 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -85.66 91.66 8.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.243 0.544 . . . . 0.0 109.733 179.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.58 -34.23 2.07 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.23 -57.66 7.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.511 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.48 8.72 6.5 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -176.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.692 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.93 -47.27 8.43 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -178.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 t -59.84 -54.18 38.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.915 0.388 . . . . 0.0 110.747 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -65.55 -33.36 75.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.959 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.674 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.7 mt-10 -66.09 -45.39 81.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.57 ' HD3' HG23 ' B' ' 63' ' ' ILE . 17.6 ttp180 -56.06 -47.91 77.04 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . 0.725 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -61.22 -44.19 97.67 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 113.619 -1.628 . . . . 0.0 111.96 179.797 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.61 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.704 0.229 . . . . 0.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.845 HG13 HD11 ' B' ' 26' ' ' LEU . 45.4 t -62.81 -44.69 99.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.725 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.8 OUTLIER -58.82 -52.68 64.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.793 178.254 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . 0.457 ' HA ' ' HG2' ' B' ' 97' ' ' GLN . 1.2 m-20 -58.67 -53.29 59.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.81 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.718 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.2 tp -60.64 -38.58 85.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.401 HD12 HG12 ' B' ' 92' ' ' VAL . 25.8 mt -70.15 -45.44 66.76 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 178.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . 0.457 ' HG2' ' HA ' ' B' ' 94' ' ' ASP . 19.7 pt20 -64.85 -18.07 64.83 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.218 1.009 . . . . 0.0 109.195 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -85.91 -49.78 7.61 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.928 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.718 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -78.96 -47.25 16.68 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.473 -1.694 . . . . 0.0 115.146 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.659 HD23 ' HB3' ' B' ' 47' ' ' TYR . 34.9 mt -52.23 -56.3 23.43 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 32.2 Cg_exo -61.59 -13.43 29.72 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.398 2.065 . . . . 0.0 113.417 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 7.9 mtmm -85.48 -23.17 27.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.982 0.42 . . . . 0.0 110.285 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 . . . . . 0 C--N 1.325 -0.495 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.944 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 399' ' ' GLU . . . . . 0.869 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 63.0 tt0 . . . . . 0 CA--C 1.509 -0.624 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 400' ' ' ASP . . . . . 0.631 ' HB3' ' CD1' ' A' ' 403' ' ' PHE . 0.8 OUTLIER -133.67 90.74 2.75 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -175.513 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 401' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -138.99 -48.41 0.5 Allowed 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -72.06 13.59 0.29 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.929 0.871 . . . . 0.0 110.538 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 403' ' ' PHE . . . . . 1.004 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -61.68 119.39 8.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.192 -1.367 . . . . 0.0 111.025 179.553 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.775 -179.082 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.42 HG11 HG12 ' B' ' 11' ' ' ILE . 63.9 t . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.7 mt -82.78 -31.11 28.42 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.515 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.6 tp -132.53 123.03 25.74 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.42 HG12 HG11 ' B' ' 8' ' ' VAL . 73.1 mt -109.6 120.64 61.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 177.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . 0.758 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.0 t -112.91 149.62 15.32 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' LYS . . . . . 0.61 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -109.48 -179.94 3.97 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.984 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . 0.429 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.8 mttp 17.95 76.31 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 125.393 1.683 . . . . 0.0 113.533 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.61 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.6 t -127.9 125.0 64.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.596 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 1.4 mtt-85 -99.04 146.11 26.39 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.388 0.614 . . . . 0.0 112.201 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . 0.536 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 6.4 tp-100 -119.75 102.71 8.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 1.1 mptp? 55.61 56.73 5.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.104 -178.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 3.2 mptm? 76.33 9.75 3.1 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 178.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' GLN . . . . . 0.691 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 5.9 pt20 -119.56 119.65 34.41 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.173 0.897 . . . . 0.0 110.755 178.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.538 ' OD2' ' HD3' ' B' ' 16' ' ' ARG . 2.1 m-20 -72.42 149.68 44.04 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.639 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -175.98 -161.31 24.97 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.744 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.36 139.45 53.66 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.884 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.75 137.28 39.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.743 -178.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -133.46 108.72 8.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.826 0.346 . . . . 0.0 110.412 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.954 HD11 HG13 ' B' ' 92' ' ' VAL . 10.7 mt -84.59 121.42 27.6 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.905 0.383 . . . . 0.0 110.332 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' MET . . . . . 0.451 ' HB2' ' HG2' ' B' ' 30' ' ' ARG . 0.5 OUTLIER -99.38 166.32 11.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.486 -178.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.2 -52.99 8.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' GLU . . . . . 0.454 ' CD ' HH21 ' B' ' 30' ' ' ARG . 1.5 mp0 -114.2 7.03 16.46 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' ARG . . . . . 0.454 HH21 ' CD ' ' B' ' 29' ' ' GLU . 10.1 ptp180 -158.94 157.86 32.2 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.513 -0.875 . . . . 0.0 112.682 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' ILE . . . . . 0.966 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -103.68 119.03 51.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.345 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.529 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -115.31 147.07 40.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.911 0.386 . . . . 0.0 110.801 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' TRP . . . . . 0.884 ' HB2' HD12 ' B' ' 24' ' ' LEU . 35.9 t90 -147.18 145.46 29.51 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 1.064 ' HB1' ' HG3' ' B' ' 38' ' ' LYS . . . -145.44 133.23 10.45 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.746 -0.206 . . . . 0.0 111.183 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' PRO . . . . . 0.639 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 69.7 Cg_endo -70.68 132.77 22.48 Favored 'Trans proline' 0 N--CA 1.476 0.474 0 C-N-CA 123.457 2.771 . . . . 0.0 111.79 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.546 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 0.0 OUTLIER -50.3 132.17 24.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.194 -178.453 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.73 11.03 39.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -177.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 1.064 ' HG3' ' HB1' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -99.62 166.7 11.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.585 -0.807 . . . . 0.0 111.953 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -124.22 -4.98 7.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.444 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -146.2 164.09 33.35 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.259 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.66 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 36.2 m-85 -88.22 130.86 34.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.229 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.3 p -94.33 -25.92 16.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.56 . . . . 0.0 110.32 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.768 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -106.04 120.68 57.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.302 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 45.8 t -147.91 101.43 3.3 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' HIS . . . . . 0.422 ' CD2' HG23 ' B' ' 43' ' ' ILE . 79.9 m-70 -123.33 137.96 54.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' MET . . . . . 0.472 ' O ' HG12 ' B' ' 50' ' ' ILE . 70.9 mmm -85.9 140.91 29.96 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.709 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.9 m-85 -57.66 -22.85 48.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.969 0.414 . . . . 0.0 110.501 179.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.77 -22.31 60.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.807 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.617 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -96.32 -6.82 36.87 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.11 0.481 . . . . 0.0 110.067 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.64 ' HB ' HD22 ' B' ' 100' ' ' LEU . 4.4 mm -87.28 118.22 32.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.618 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 0.6 OUTLIER -79.39 -30.88 42.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.226 0.536 . . . . 0.0 109.615 -178.655 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.618 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 9.4 p -176.1 173.69 2.17 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.751 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 18.8 pm0 -132.42 137.91 47.46 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.199 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 1.137 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -104.75 148.97 26.02 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.517 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.8 OUTLIER -127.25 127.04 68.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 175.998 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -88.3 116.66 66.88 Favored Pre-proline 0 C--O 1.252 1.188 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.83 173.3 11.23 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 125.211 3.941 . . . . 0.0 114.484 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -60.73 160.33 9.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.47 -29.06 8.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.331 -1.507 . . . . 0.0 109.331 -177.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.869 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.5 mttp -88.45 152.26 22.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 176.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.4 -8.98 51.42 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 121.127 0.489 . . . . 0.0 110.942 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' LYS . . . . . 0.508 ' CE ' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -141.74 140.8 33.2 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.597 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' ILE . . . . . 0.594 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.4 mp -86.31 135.49 24.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 178.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -139.5 163.31 32.88 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 118.897 -1.121 . . . . 0.0 113.992 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 1.7 tp -138.88 153.07 48.26 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.054 -1.43 . . . . 0.0 107.522 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 1.137 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 142.96 28.3 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 119.25 0.932 . . . . 0.0 111.183 178.201 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.966 HD11 HD13 ' B' ' 31' ' ' ILE . 95.7 mt -95.29 103.13 14.98 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.925 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.743 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.3 t -87.12 115.94 28.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.534 HD22 HD13 ' B' ' 50' ' ' ILE . 4.1 mt -101.13 154.87 18.36 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.11 0.481 . . . . 0.0 111.952 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.617 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.43 -1.95 36.05 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.384 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.99 -15.3 61.1 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.63 178.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 102.8 7.45 44.61 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.929 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' ASP . . . . . 0.488 ' OD2' HD12 ' B' ' 69' ' ' LEU . 4.8 p-10 -126.44 167.71 15.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.117 0.484 . . . . 0.0 111.572 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . 0.743 HG22 ' HA ' ' B' ' 68' ' ' VAL . 33.2 p -136.63 131.45 33.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.752 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.2 m -100.57 99.33 9.89 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 178.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' ASN . . . . . 0.44 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.5 m-20 -82.46 148.17 28.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.238 0.542 . . . . 0.0 111.485 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' PHE . . . . . 0.768 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 54.0 m-85 -131.59 113.99 14.3 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.767 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' HIS . . . . . 0.563 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.8 t-160 -87.05 105.3 17.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.447 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.751 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 29.0 m-85 -76.41 97.48 4.29 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.401 ' HB3' ' CZ ' ' B' ' 16' ' ' ARG . 0.6 OUTLIER -95.18 7.27 46.67 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' ASN . . . . . 0.429 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 54.7 t30 -81.35 91.19 6.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.128 0.49 . . . . 0.0 110.451 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.66 -24.97 9.52 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -59.98 2.46 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' THR . . . . . 0.525 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.7 p -127.82 13.46 6.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -176.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . 0.751 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -46.15 -44.36 15.79 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.447 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.6 -53.52 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.027 0.442 . . . . 0.0 110.488 179.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.525 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.48 -34.91 78.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.264 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . 0.672 ' O ' HG23 ' B' ' 92' ' ' VAL . 13.5 mt-10 -67.5 -44.22 78.99 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . 0.594 ' HD3' HG23 ' B' ' 63' ' ' ILE . 22.5 ttp180 -55.42 -47.08 76.52 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.133 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -42.28 99.27 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.57 -1.65 . . . . 0.0 112.466 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.47 -43.65 76.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.72 0.236 . . . . 0.0 111.078 179.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.954 HG13 HD11 ' B' ' 26' ' ' LEU . 35.2 t -60.28 -44.45 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 177.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' B' ' 97' ' ' GLN . 0.5 OUTLIER -58.18 -54.87 42.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.089 178.337 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . 0.602 ' HA ' ' NE2' ' B' ' 97' ' ' GLN . 4.2 m-20 -56.73 -53.95 51.88 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.195 -179.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.646 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.5 tp -61.56 -32.67 72.76 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.472 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.63 -41.12 65.86 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 97' ' ' GLN . . . . . 0.602 ' NE2' ' HA ' ' B' ' 94' ' ' ASP . 7.4 mt-30 -63.08 -22.67 67.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.149 0.976 . . . . 0.0 108.684 178.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.63 -47.42 9.2 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.793 -1.549 . . . . 0.0 111.439 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 99' ' ' LEU . . . . . 0.646 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.7 mt -80.05 -47.76 14.35 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.124 -1.398 . . . . 0.0 114.757 -176.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.709 HD23 ' HB3' ' B' ' 47' ' ' TYR . 59.2 mt -52.55 -56.97 17.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -176.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 101' ' ' PRO . . . . . 0.652 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.1 Cg_exo -56.83 -13.19 10.74 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.711 2.274 . . . . 0.0 113.875 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -87.15 -9.5 55.09 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.368 -0.208 . . . . 0.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.496 -179.774 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 30.2 p90 . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 23.1 t -61.48 119.83 6.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.758 0.313 . . . . 0.0 110.545 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 87.83 -78.02 1.84 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.77 -0.728 . . . . 0.0 111.331 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -91.45 119.96 31.88 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -133.81 29.24 3.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.798 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.516 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -60.31 -35.57 75.91 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.342 179.033 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 4.1 tt0 169.21 -79.25 0.0 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.693 177.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.984 ' HG3' ' HE2' ' B' ' 62' ' ' LYS . 0.5 OUTLIER -139.78 113.12 8.35 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.255 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -138.44 84.46 2.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.203 -178.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.544 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -139.09 -49.49 0.51 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.234 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -71.29 11.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.602 0.715 . . . . 0.0 110.177 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.728 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -54.76 114.12 1.59 Allowed 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.186 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -94.36 133.1 38.28 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.268 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.43 ' HG2' ' HG2' ' B' ' 54' ' ' LYS . 23.2 mm-40 -81.14 175.09 10.94 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.952 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -164.28 -22.22 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.104 -0.638 . . . . 0.0 111.738 178.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.78 -19.75 37.18 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.157 179.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 75.82 -174.4 0.11 Allowed 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.598 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.27 86.23 3.7 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 121.568 0.699 . . . . 0.0 111.232 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.64 ' HB3' ' HG2' ' B' ' 51' ' ' LYS . 16.1 t70 . . . . . 0 C--O 1.245 0.865 0 CA-C-N 115.142 -0.936 . . . . 0.0 109.43 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.63 61.86 0.31 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 109.945 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 12.7 m -156.64 -68.07 0.11 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.674 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.52 -18.7 14.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.949 0.404 . . . . 0.0 111.051 -179.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . 0.505 ' HB3' ' HB2' ' B' ' 29' ' ' GLU . 4.6 p -76.79 19.73 0.27 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.85 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -105.77 2.08 27.57 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.852 0.834 . . . . 0.0 109.039 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -112.76 135.92 52.96 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.938 -1.483 . . . . 0.0 108.891 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 99.0 t -93.34 122.52 44.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.19 0.519 . . . . 0.0 111.471 -178.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.5 mt -95.57 -29.51 14.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.498 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.605 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.07 123.91 26.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.749 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.442 HG23 ' CE1' ' B' ' 25' ' ' TYR . 55.5 mt -108.95 122.65 63.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.839 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.9 t -115.07 150.05 17.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.611 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.66 177.25 4.74 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.064 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.579 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.15 75.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 125.555 1.784 . . . . 0.0 112.971 -178.654 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.611 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.1 t -123.82 119.7 57.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.1 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.593 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 30.8 mtp180 -89.42 128.42 35.94 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.858 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -126.9 104.33 7.97 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.68 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.22 50.88 0.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.771 179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.516 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 0.3 OUTLIER 66.26 26.13 10.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.752 178.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.523 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.1 tt0 -138.31 121.59 17.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.745 -0.207 . . . . 0.0 110.776 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.436 ' HA ' ' HA ' ' B' ' 16' ' ' ARG . 2.1 t70 -76.94 154.0 34.06 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.894 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -178.27 -156.12 15.97 Favored Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.218 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 133.57 48.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.955 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.47 142.19 29.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.516 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . 0.442 ' CE1' HG23 ' B' ' 11' ' ' ILE . 50.3 m-85 -137.72 110.59 7.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.97 HD11 HG13 ' B' ' 92' ' ' VAL . 9.3 mt -87.97 128.45 35.38 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 12.5 mtt -108.24 166.6 10.63 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.63 -47.91 14.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.505 ' HB2' ' HB3' ' B' ' 5' ' ' SER . 4.0 mt-10 -117.11 3.68 12.71 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.448 ' HG2' ' HB2' ' B' ' 5' ' ' SER . 12.4 ptt180 -156.11 153.24 29.02 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.624 -0.83 . . . . 0.0 112.515 -177.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.998 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.78 121.43 52.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.09 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.08 153.74 37.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.913 0.387 . . . . 0.0 110.783 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.955 ' HB2' HD12 ' B' ' 24' ' ' LEU . 45.6 t90 -147.26 134.17 20.21 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.475 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -111.98 127.41 26.9 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.714 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.502 ' HG2' ' HB2' ' B' ' 38' ' ' LYS . 58.9 Cg_endo -75.05 142.69 28.0 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.461 2.107 . . . . 0.0 111.801 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -58.77 133.6 56.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.721 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.11 -5.81 75.66 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.398 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.502 ' HB2' ' HG2' ' B' ' 35' ' ' PRO . 1.7 mppt? -113.39 153.55 28.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -98.04 -11.94 22.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.3 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -118.66 152.9 35.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.081 0.467 . . . . 0.0 112.002 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.475 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 21.7 m-85 -81.19 122.8 27.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.6 p -91.58 -8.72 46.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.269 0.557 . . . . 0.0 110.328 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.684 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 15.2 mm -117.08 119.54 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.189 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.3 t -148.0 101.52 3.3 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.474 ' CD2' HG23 ' B' ' 43' ' ' ILE . 73.8 m-70 -124.87 137.72 54.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.004 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.485 ' HB2' ' OD2' ' B' ' 49' ' ' ASP . 21.6 mmm -86.53 140.27 30.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.645 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.7 m-85 -57.56 -23.08 48.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.846 0.355 . . . . 0.0 110.544 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.13 -20.48 61.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.968 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.579 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -98.55 -8.89 25.75 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.087 0.47 . . . . 0.0 110.318 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.693 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.7 mm -87.43 127.66 40.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.64 ' HG2' ' HB3' ' A' ' 410' ' ' ASP . 7.6 tttp -88.44 -46.67 8.95 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.548 0.689 . . . . 0.0 109.727 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.667 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.8 p -154.48 -177.9 6.78 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.145 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . 0.598 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 10.3 pt20 -144.18 143.34 31.04 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.717 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.002 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 25.7 mttp -113.08 153.04 28.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.501 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -130.06 127.04 62.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 176.202 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -87.51 120.0 70.95 Favored Pre-proline 0 C--O 1.249 1.041 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -70.51 172.94 12.41 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 124.864 3.709 . . . . 0.0 113.928 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -61.76 160.3 12.06 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.888 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.01 8.1 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.59 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 5.2 mttp -85.11 162.96 19.06 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.26 -5.85 46.76 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.308 0.575 . . . . 0.0 110.478 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.984 ' HE2' ' HG3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -146.86 157.73 43.73 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.373 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.611 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -96.64 134.44 34.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 177.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.563 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 24.0 mt-30 -135.5 163.24 30.52 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.596 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -141.83 153.22 44.34 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 113.547 -1.66 . . . . 0.0 107.377 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.002 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -146.54 139.68 25.58 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 119.052 0.842 . . . . 0.0 111.256 178.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.998 HD11 HD13 ' B' ' 31' ' ' ILE . 96.2 mt -94.23 104.58 16.58 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.77 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.667 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.5 t -91.36 111.71 24.28 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.482 HD22 HD13 ' B' ' 50' ' ' ILE . 5.2 mt -94.23 157.57 15.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.579 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -79.02 -4.77 51.73 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.423 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.8 -5.61 53.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.636 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.6 20.69 50.45 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.409 ' HB3' HD12 ' B' ' 69' ' ' LEU . 20.9 t70 -125.91 158.78 34.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.354 -0.423 . . . . 0.0 110.415 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.552 HG22 ' HA ' ' B' ' 68' ' ' VAL . 16.1 p -137.5 131.14 31.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.836 0.351 . . . . 0.0 110.316 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.539 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.13 101.09 10.6 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.062 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.51 137.92 32.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.207 0.527 . . . . 0.0 111.719 -178.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.684 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 53.2 m-85 -122.77 111.46 16.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.899 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.593 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.8 t-160 -88.43 104.14 16.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.132 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.596 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 58.4 m-85 -75.09 100.22 4.16 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.14 -2.02 47.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.579 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.2 t-20 -79.78 91.29 5.31 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.27 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.86 -37.77 9.32 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 52.4 m -53.85 -59.42 4.65 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.534 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.6 p -127.57 9.94 6.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -176.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.512 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.41 -48.9 7.17 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.549 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.1 -51.87 67.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.983 0.421 . . . . 0.0 110.87 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.534 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 7.6 mttt -67.48 -34.92 78.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.053 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.661 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.9 mt-10 -64.64 -46.86 80.73 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.611 ' HD3' HG23 ' B' ' 63' ' ' ILE . 25.3 ttp180 -53.83 -47.73 70.63 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.88 -46.47 87.7 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.6 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.08 -42.39 89.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 118.137 0.426 . . . . 0.0 111.164 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.97 HG13 HD11 ' B' ' 26' ' ' LEU . 47.9 t -60.95 -43.87 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.598 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.3 ttpm? -59.52 -55.21 37.49 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.843 178.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.75 -54.12 42.65 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.908 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.733 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.5 tp -61.99 -38.36 88.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.807 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.411 HD12 HG12 ' B' ' 92' ' ' VAL . 24.7 mt -70.58 -43.31 69.66 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.408 ' N ' HE22 ' B' ' 53' ' ' GLN . 37.3 mt-30 -63.69 -21.13 66.23 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 122.158 0.98 . . . . 0.0 109.051 178.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -84.15 -50.59 7.79 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.201 -1.363 . . . . 0.0 110.159 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.733 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.4 mt -78.62 -46.68 18.71 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -176.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.693 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.2 mt -49.86 -60.07 5.74 Favored Pre-proline 0 N--CA 1.468 0.443 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -176.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.87 -13.88 37.46 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.17 1.913 . . . . 0.0 113.828 -178.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 18.9 mtmm -87.78 -6.34 58.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.433 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -127.18 -28.18 2.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.63 ' HE2' ' HB3' ' B' ' 100' ' ' LEU . 7.5 pttt -94.92 170.06 9.7 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.31 0.576 . . . . 0.0 111.364 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.86 128.6 20.43 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 178.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.473 ' HA ' ' OD1' ' A' ' 410' ' ' ASP . 8.5 mtpm? -46.5 149.71 0.75 Allowed 'General case' 0 C--N 1.327 -0.39 0 O-C-N 124.174 0.922 . . . . 0.0 112.528 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.27 4.53 38.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.322 1.058 . . . . 0.0 108.504 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 41.8 t30 . . . . . 0 C--O 1.251 1.179 0 CA-C-N 113.065 -1.88 . . . . 0.0 108.159 179.75 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.433 ' HD1' HG12 ' A' ' 393' ' ' VAL . 5.5 p90 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . 0.433 HG12 ' HD1' ' A' ' 392' ' ' TYR . 5.9 p -61.54 -43.48 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 120.855 0.36 . . . . 0.0 110.867 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -89.32 70.34 2.45 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.63 ' OE2' ' HE2' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 75.4 157.42 0.19 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.591 0.756 . . . . 0.0 110.096 -178.281 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.533 ' O ' ' HE3' ' B' ' 19' ' ' LYS . 3.2 t70 -130.19 31.24 4.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.637 -178.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.506 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 0.8 OUTLIER -57.48 -42.18 82.14 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.562 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 7.7 tt0 172.86 -62.01 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.671 0.607 . . . . 0.0 111.119 178.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.946 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.8 tt0 -154.58 90.69 1.34 Allowed 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.457 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -132.24 93.09 3.2 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.508 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.9 p-10 -138.42 -45.34 0.5 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.618 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.5 p30 -74.12 13.37 0.56 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.723 0.773 . . . . 0.0 110.645 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 1.028 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.52 123.93 17.89 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.547 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -112.09 128.72 56.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.773 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.583 ' HG2' ' HG2' ' B' ' 54' ' ' LYS . 3.3 mt-10 -72.34 -76.32 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.819 0.342 . . . . 0.0 110.882 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 73.08 3.9 4.79 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.956 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . 0.857 ' HB3' ' HB2' ' B' ' 52' ' ' CYS . 22.5 t70 -111.17 -1.66 16.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.81 0.814 . . . . 0.0 108.985 178.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.439 ' HB3' ' H ' ' A' ' 409' ' ' ASP . 0.4 OUTLIER 51.45 -139.21 0.99 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.054 -1.43 . . . . 0.0 113.047 179.027 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.439 ' H ' ' HB3' ' A' ' 408' ' ' GLU . 0.1 OUTLIER -109.38 -163.66 0.88 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.977 -178.714 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.492 ' HB3' ' HD2' ' B' ' 104' ' ' LYS . 2.1 p30 . . . . . 0 C--O 1.253 1.271 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.978 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.4 tpt . . . . . 0 N--CA 1.481 1.087 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . 0.661 ' HB2' ' HB2' ' B' ' 40' ' ' ARG . . . -111.28 178.05 4.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.73 -0.214 . . . . 0.0 110.609 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.49 53.17 1.5 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.141 0.496 . . . . 0.0 111.352 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -153.57 109.88 3.33 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 21.0 m -152.02 47.07 0.77 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.992 0.425 . . . . 0.0 110.823 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.419 ' HB2' ' HB3' ' B' ' 27' ' ' MET . 16.5 mp0 -90.51 -175.33 4.42 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.433 ' O ' ' HA ' ' B' ' 27' ' ' MET . 6.0 tp10 -63.51 113.69 3.45 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.773 0.32 . . . . 0.0 110.837 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 80.2 t -82.93 115.44 25.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.035 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.474 ' HB2' HD21 ' B' ' 95' ' ' LEU . 48.5 mt -94.94 -29.06 14.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.393 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.41 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.7 tp -142.61 138.32 30.66 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.8 mt -121.57 121.59 64.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.1 t -112.06 149.21 14.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.819 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.551 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.71 178.16 4.56 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.356 -0.384 . . . . 0.0 109.977 -179.63 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.525 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 12.7 mtpt 17.94 74.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 O-C-N 125.344 1.653 . . . . 0.0 113.727 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 13' ' ' LYS . 50.2 t -119.28 121.61 66.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.773 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.624 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 95.6 mtt180 -89.26 135.73 33.42 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.193 0.521 . . . . 0.0 111.464 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -130.57 106.53 8.56 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.63 ' HE2' ' OE2' ' A' ' 395' ' ' GLU . 0.5 OUTLIER 63.49 49.97 2.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.033 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.533 ' HE3' ' O ' ' A' ' 396' ' ' ASP . 0.7 OUTLIER 70.7 25.6 4.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.205 178.754 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.522 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 9.8 tt0 -134.96 119.5 18.07 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.089 -0.244 . . . . 0.0 111.212 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.64 153.31 43.62 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.915 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.47 -157.95 19.51 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.314 -0.469 . . . . 0.0 112.474 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -129.33 132.18 47.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.833 0.349 . . . . 0.0 110.334 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.901 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -97.43 130.95 44.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.029 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -124.05 128.43 49.33 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.872 HD11 HG13 ' B' ' 92' ' ' VAL . 22.2 mt -108.47 118.01 35.67 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.433 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.2 mpt? -98.65 165.22 11.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.026 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.8 -50.65 44.11 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.309 -0.86 . . . . 0.0 113.226 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -104.49 -3.75 23.57 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 167.2 30.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 119.421 -0.912 . . . . 0.0 112.704 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.805 HD12 HD11 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -115.9 125.66 73.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.664 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -129.92 119.02 22.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.236 0.541 . . . . 0.0 111.424 -178.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.901 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.8 t90 -112.05 133.82 53.98 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.002 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.483 ' HB2' ' CD2' ' B' ' 41' ' ' PHE . . . -115.67 135.28 22.64 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.231 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.828 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -74.1 150.84 43.52 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.576 2.184 . . . . 0.0 111.617 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -61.32 133.22 55.62 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.182 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.91 8.92 86.06 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.805 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.828 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.37 146.58 39.23 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.45 -0.441 . . . . 0.0 110.505 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . 0.465 ' OD2' ' HD2' ' B' ' 40' ' ' ARG . 2.4 p-10 -94.99 0.39 54.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.473 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.661 ' HB2' ' HB2' ' B' ' 2' ' ' ALA . 0.0 OUTLIER -136.39 151.65 49.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.104 0.478 . . . . 0.0 111.785 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.531 ' HD1' ' HB3' ' B' ' 2' ' ' ALA . 35.5 m-85 -82.24 121.77 27.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.393 -0.821 . . . . 0.0 108.94 178.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.2 p -86.5 -19.8 28.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.162 0.506 . . . . 0.0 110.3 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.789 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 49.5 mm -108.63 110.68 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.803 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 7.5 t -137.69 101.6 4.51 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -129.13 144.24 51.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.045 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.468 ' O ' HG12 ' B' ' 50' ' ' ILE . 76.6 mmm -88.58 143.94 26.63 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.711 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -61.82 -18.97 61.95 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.89 -15.02 60.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.506 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.603 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.69 -6.02 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 109.983 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.663 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.9 mm -90.42 129.23 41.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.471 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 11.2 ttpt -86.32 -33.44 20.6 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.24 0.543 . . . . 0.0 109.825 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.857 ' HB2' ' HB3' ' A' ' 407' ' ' ASP . 27.5 p -178.38 -178.16 0.6 Allowed 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.089 -0.96 . . . . 0.0 108.638 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . 0.443 ' OE1' HD12 ' B' ' 100' ' ' LEU . 5.4 pm0 -134.89 140.94 46.18 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.996 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.091 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 47.1 mttp -102.2 145.29 29.62 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.528 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -124.15 129.39 74.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.099 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 176.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.494 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -90.17 117.52 68.12 Favored Pre-proline 0 C--O 1.251 1.138 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.59 173.03 10.49 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 125.165 3.91 . . . . 0.0 114.441 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.7 mp0 -61.12 160.48 10.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.069 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.76 -28.94 8.13 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.946 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.8 mttp -87.79 152.8 21.84 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.65 -20.34 66.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.228 0.537 . . . . 0.0 110.322 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.735 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.1 OUTLIER -135.48 144.0 46.15 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.923 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.658 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -85.44 142.36 13.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.54 ' HG2' ' HA ' ' B' ' 78' ' ' HIS . 21.0 mt-30 -141.01 163.51 32.78 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.421 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -141.96 153.46 44.34 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.039 -1.437 . . . . 0.0 108.04 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.091 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.71 146.03 30.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 119.045 0.839 . . . . 0.0 110.678 178.18 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.805 HD11 HD12 ' B' ' 31' ' ' ILE . 55.7 mt -97.19 106.65 19.01 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.149 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.592 ' HA ' HG22 ' B' ' 74' ' ' THR . 14.1 t -91.72 124.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.45 HD22 HD13 ' B' ' 50' ' ' ILE . 5.5 mt -108.08 153.91 22.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.022 0.439 . . . . 0.0 112.151 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.603 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -76.06 -5.48 46.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.768 0.794 . . . . 0.0 108.977 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.2 -4.64 48.67 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.6 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.26 20.68 51.77 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.465 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.447 ' HB3' HD12 ' B' ' 69' ' ' LEU . 23.5 t70 -126.2 160.47 30.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.561 -0.32 . . . . 0.0 110.509 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.592 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.8 p -141.65 131.22 23.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.048 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.577 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 10.5 m -110.21 104.17 12.96 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.106 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.4 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 7.5 m-20 -82.26 153.58 25.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.235 0.54 . . . . 0.0 112.206 -178.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.789 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 64.5 m-85 -140.02 111.31 7.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.857 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.624 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.78 112.01 21.29 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.731 ' HE2' ' HB3' ' B' ' 88' ' ' GLU . 20.6 m-85 -76.91 92.52 3.66 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.2 9.16 34.88 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.525 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 52.2 t30 -84.76 92.75 8.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.03 0.443 . . . . 0.0 110.238 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -49.85 -32.0 13.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.678 -178.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.99 -60.63 3.02 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -178.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.481 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.7 p -128.27 14.19 6.67 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.707 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.96 -46.02 10.85 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.412 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.56 -54.52 33.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.481 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -64.66 -37.64 88.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.229 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.731 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 14.2 mt-10 -65.5 -45.17 84.61 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.278 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.658 ' HD3' HG23 ' B' ' 63' ' ' ILE . 19.2 ttp180 -54.99 -47.02 75.18 Favored 'General case' 0 CA--C 1.509 -0.605 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.03 -44.96 95.59 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 113.536 -1.665 . . . . 0.0 112.568 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.93 -42.09 81.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 117.841 0.291 . . . . 0.0 111.073 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.872 HG13 HD11 ' B' ' 26' ' ' LEU . 34.0 t -62.41 -42.21 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.17 -56.2 25.18 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.579 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.09 -52.59 63.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.087 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.724 ' HG ' HD12 ' B' ' 99' ' ' LEU . 15.1 tp -61.96 -42.54 99.24 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.038 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.491 HD12 HG12 ' B' ' 92' ' ' VAL . 19.1 mt -68.23 -43.47 77.88 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.73 -21.31 65.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 122.361 1.077 . . . . 0.0 109.347 178.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.42 -50.93 6.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.164 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.724 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.8 mt -74.28 -50.88 17.08 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 113.452 -1.704 . . . . 0.0 114.675 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.711 HD23 ' HB3' ' B' ' 47' ' ' TYR . 40.5 mt -49.87 -57.53 12.12 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.613 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 62.2 Cg_exo -54.84 -16.92 12.51 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.614 2.209 . . . . 0.0 114.076 -179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -87.52 -13.65 42.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.754 0.312 . . . . 0.0 110.945 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.509 ' O ' ' HD3' ' B' ' 105' ' ' ARG . 70.4 m-85 -121.37 -29.85 4.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.793 -179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' B' ' 100' ' ' LEU . 52.9 pttt -85.03 124.8 32.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.203 0.525 . . . . 0.0 111.158 -179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.509 ' HD3' ' O ' ' B' ' 103' ' ' PHE . 0.0 OUTLIER -150.83 116.03 5.35 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -64.83 -37.87 89.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.712 0.291 . . . . 0.0 111.551 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -143.23 61.78 1.39 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.782 0.325 . . . . 0.0 111.001 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 0.999 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.475 ' HB2' ' H ' ' A' ' 393' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . 0.475 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 6.4 m -67.4 142.05 17.05 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 82.16 -67.31 3.71 Favored Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.791 ' HG2' ' H ' ' B' ' 76' ' ' ASN . 2.9 tp10 -108.1 95.99 6.06 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -98.22 29.66 3.45 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.37 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.504 ' HA ' ' HD3' ' B' ' 19' ' ' LYS . 12.2 t70 -41.3 -43.03 2.33 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.493 ' HB3' ' H ' ' A' ' 399' ' ' GLU . 3.1 tt0 175.19 -96.13 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.921 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.1 tt0 -117.54 99.71 7.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.463 -177.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.509 ' HB2' ' CD2' ' A' ' 403' ' ' PHE . 9.4 p-10 -135.64 92.1 2.79 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.351 0.596 . . . . 0.0 112.241 -177.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.518 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.3 p-10 -139.48 -46.99 0.46 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 18.8 p30 -73.14 11.56 0.7 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.786 0.803 . . . . 0.0 110.44 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.888 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -55.49 116.14 2.71 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.39 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -100.57 131.04 46.69 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.645 ' HA ' ' HA ' ' B' ' 54' ' ' LYS . 2.5 tt0 -81.12 -69.93 0.57 Allowed 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -177.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 85.64 -27.42 0.09 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.765 0.826 . . . . 0.0 109.01 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . 0.493 ' HB3' ' CB ' ' B' ' 52' ' ' CYS . 0.2 OUTLIER -79.39 -36.25 39.48 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 176.484 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.437 ' HB3' ' H ' ' A' ' 409' ' ' ASP . 0.5 OUTLIER 62.41 -159.92 0.31 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 113.83 -1.532 . . . . 0.0 112.792 177.179 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' A' ' 408' ' ' GLU . 40.8 t0 -76.27 69.5 2.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.759 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.495 ' OXT' ' HE3' ' B' ' 106' ' ' LYS . 26.4 t70 . . . . . 0 C--O 1.243 0.744 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.751 ' HG3' ' HB2' ' B' ' 6' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.938 0 CA-C-O 120.364 0.126 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.8 -146.28 0.14 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.889 0.376 . . . . 0.0 110.692 -179.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.79 78.16 8.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.618 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 13.3 m 66.08 52.9 1.13 Allowed 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 121.553 0.692 . . . . 0.0 110.441 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 14.7 m -148.93 105.38 3.53 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.412 -0.813 . . . . 0.0 108.874 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.751 ' HB2' ' HG3' ' B' ' 1' ' ' MET . 70.3 mm-40 72.59 36.4 0.99 Allowed 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -178.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.592 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -89.12 101.72 14.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.25 -179.784 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 95.5 t -82.01 115.88 25.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.048 0.451 . . . . 0.0 110.246 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.426 ' HB2' HD21 ' B' ' 95' ' ' LEU . 25.7 mt -97.53 -29.75 13.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.841 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.0 tp -139.5 140.4 37.2 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 79.4 mt -122.59 121.94 64.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.775 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.3 t -111.96 148.21 15.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.929 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.597 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.03 175.68 5.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.012 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.556 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.1 79.68 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 O-C-N 125.393 1.683 . . . . 0.0 113.61 -179.62 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.597 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.6 t -130.74 126.98 61.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 114.878 -1.056 . . . . 0.0 108.957 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.591 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 9.2 mtm180 -95.16 144.87 25.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.316 0.579 . . . . 0.0 111.258 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.608 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.8 110.33 6.68 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.424 ' NZ ' ' HA ' ' A' ' 395' ' ' GLU . 13.0 tppt? 67.82 52.19 0.74 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.627 0.727 . . . . 0.0 110.003 -179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.504 ' HD3' ' HA ' ' A' ' 397' ' ' ASP . 0.3 OUTLIER 62.89 25.28 14.99 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.869 178.107 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.555 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.6 pt20 -138.32 131.72 30.49 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.98 -0.45 . . . . 0.0 110.263 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.418 ' HA ' ' HA ' ' B' ' 16' ' ' ARG . 2.1 t70 -82.72 153.52 25.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -177.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -177.11 -154.77 12.42 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.914 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.78 136.65 50.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.085 0.469 . . . . 0.0 110.077 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.941 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.44 141.79 30.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.938 -178.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 40.2 m-85 -133.19 122.54 24.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.857 HD11 HG13 ' B' ' 92' ' ' VAL . 19.6 mt -104.34 120.67 41.71 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.8 -178.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.592 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.3 mpt? -100.99 161.61 13.47 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.19 -20.41 65.39 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -107.78 -20.2 13.29 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -161.9 167.67 24.28 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.782 -0.767 . . . . 0.0 112.824 -176.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.855 HD13 HD11 ' B' ' 67' ' ' LEU . 1.1 tt -109.65 117.71 55.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -119.05 152.65 36.06 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.969 0.414 . . . . 0.0 110.752 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.941 ' HB2' HD12 ' B' ' 24' ' ' LEU . 38.3 t90 -147.32 140.78 25.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.408 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -125.51 138.16 31.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.944 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' B' ' 34' ' ' ALA . 12.5 Cg_exo -68.33 153.6 73.89 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.644 2.229 . . . . 0.0 111.374 179.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -65.23 116.01 6.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.964 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.96 4.1 54.48 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.432 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.549 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -97.36 143.22 28.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.582 0.706 . . . . 0.0 111.253 179.762 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.63 -14.29 52.28 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.494 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.42 156.81 45.23 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.939 0.399 . . . . 0.0 111.463 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -75.69 131.49 39.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.187 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -92.61 -28.93 16.41 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.442 0.639 . . . . 0.0 109.752 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.784 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 16.7 mm -97.57 123.84 50.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.404 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 31.2 t -147.99 101.45 3.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.486 ' CD2' HG23 ' B' ' 43' ' ' ILE . 85.0 m-70 -124.61 128.74 49.35 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.67 0.272 . . . . 0.0 110.816 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.529 ' O ' HG12 ' B' ' 50' ' ' ILE . 0.0 OUTLIER -78.96 139.72 38.17 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.565 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -58.84 -24.32 61.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.65 -8.74 57.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.57 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.71 ' HA ' ' HE2' ' B' ' 70' ' ' HIS . 0.9 OUTLIER -111.63 -10.14 14.12 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.282 0.563 . . . . 0.0 110.289 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.652 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.1 mm -91.94 130.2 41.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.434 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 11.1 tttp -89.78 -46.25 8.72 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.435 0.636 . . . . 0.0 110.08 -179.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.541 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -155.95 -177.88 6.9 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.679 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . 0.409 ' HG2' ' HB3' ' B' ' 96' ' ' LEU . 1.5 pp0? -146.48 143.11 28.74 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.713 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.097 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 46.2 mttp -108.76 156.62 19.41 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.985 0.421 . . . . 0.0 110.123 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.533 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.9 OUTLIER -132.11 130.04 60.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 176.27 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.512 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.36 117.81 68.54 Favored Pre-proline 0 C--O 1.25 1.121 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.19 173.45 12.21 Favored 'Trans proline' 0 C--N 1.344 0.298 1 C-N-CA 125.357 4.038 . . . . 0.0 114.544 -177.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.68 160.56 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.09 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.85 -29.27 7.89 Favored Glycine 0 N--CA 1.448 -0.502 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.921 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.9 mttp -91.34 150.58 21.23 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.613 -1.255 . . . . 0.0 107.613 176.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.28 -4.24 21.03 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.134 0.492 . . . . 0.0 110.742 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.411 ' CE ' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -141.81 143.94 33.68 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.756 -179.397 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.644 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.1 mp -90.55 136.62 23.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.512 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 13.8 mt-30 -138.17 163.35 31.9 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -141.09 154.03 45.74 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.184 -1.371 . . . . 0.0 107.964 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.097 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.71 143.67 28.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 118.927 0.785 . . . . 0.0 111.21 178.368 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.855 HD11 HD13 ' B' ' 31' ' ' ILE . 77.4 mt -96.02 109.77 22.12 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.138 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.583 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.7 t -95.41 108.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.499 HD22 HD13 ' B' ' 50' ' ' ILE . 4.1 mt -92.06 156.17 17.58 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.045 0.45 . . . . 0.0 112.008 -177.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.71 ' HE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -80.18 1.13 29.44 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.347 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.49 -7.61 59.63 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.251 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.0 17.56 47.03 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.745 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.22 159.37 33.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.7 0.286 . . . . 0.0 110.711 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.583 HG22 ' HA ' ' B' ' 68' ' ' VAL . 20.8 p -135.35 130.86 35.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.885 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.536 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.18 102.42 11.56 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.367 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.791 ' H ' ' HG2' ' A' ' 395' ' ' GLU . 4.0 m-20 -82.22 142.72 31.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.465 0.65 . . . . 0.0 111.742 -178.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.784 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 52.2 m-85 -126.79 115.25 19.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.206 179.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.591 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.0 t60 -87.2 110.64 20.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.866 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.767 ' HE2' ' HB3' ' B' ' 88' ' ' GLU . 26.8 m-85 -81.56 93.23 6.66 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.1 4.02 52.86 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.556 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -81.79 91.27 6.47 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 121.212 0.53 . . . . 0.0 110.332 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.7 -39.95 5.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.423 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -59.64 4.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.472 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.1 p -127.61 10.43 6.64 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -176.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.47 -46.86 9.88 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.402 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.99 -53.88 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.84 0.352 . . . . 0.0 110.772 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 3.8 mttt -65.49 -35.89 82.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.057 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.767 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.5 mt-10 -65.37 -47.26 77.0 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.644 ' HD3' HG23 ' B' ' 63' ' ' ILE . 22.3 ttp180 -54.43 -47.57 72.66 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 122.015 0.912 . . . . 0.0 108.596 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.39 -45.73 91.8 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.662 -1.608 . . . . 0.0 112.357 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.14 -40.71 90.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.909 0.322 . . . . 0.0 110.998 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.857 HG13 HD11 ' B' ' 26' ' ' LEU . 40.9 t -62.92 -43.45 98.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 177.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.76 -55.38 35.88 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 114.882 -1.054 . . . . 0.0 109.588 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.65 -53.46 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.463 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.868 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.7 tp -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.272 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.435 HD12 HG12 ' B' ' 92' ' ' VAL . 30.9 mt -71.01 -47.75 57.03 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 117.663 0.21 . . . . 0.0 110.981 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.41 -17.83 63.08 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.76 0.791 . . . . 0.0 109.757 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -88.3 -48.45 7.66 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.863 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.868 HD12 ' HG ' ' B' ' 95' ' ' LEU . 9.9 mt -79.29 -47.46 15.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.087 -1.415 . . . . 0.0 114.538 -177.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.652 HD22 ' HB ' ' B' ' 50' ' ' ILE . 26.5 mt -49.81 -53.88 37.74 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 17.4 Cg_endo -57.45 -18.52 31.94 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.332 2.021 . . . . 0.0 113.4 -179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -87.58 -8.52 56.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.715 0.293 . . . . 0.0 111.292 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -125.3 -6.01 7.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.328 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.561 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 75.3 mttt -59.43 109.08 0.81 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.985 0.421 . . . . 0.0 111.356 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 13.9 ptt-85 -80.74 63.98 5.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.35 0.595 . . . . 0.0 111.002 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.495 ' HE3' ' OXT' ' A' ' 410' ' ' ASP . 0.7 OUTLIER -115.0 145.41 42.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.189 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -102.16 20.06 17.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.145 0.497 . . . . 0.0 110.52 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.6 t30 . . . . . 0 C--O 1.245 0.851 0 CA-C-N 114.966 -1.016 . . . . 0.0 108.985 -179.856 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.421 ' N ' ' OD1' ' A' ' 396' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 14.7 p -170.24 142.2 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 70.33 -113.36 4.84 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.116 -0.793 . . . . 0.0 111.116 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.817 ' HG2' ' HB2' ' B' ' 76' ' ' ASN . 7.0 tp10 -100.46 144.44 29.45 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 392' ' ' TYR . 2.4 m-20 -135.27 29.63 3.33 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.138 -178.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.554 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 5.8 t70 -61.85 -33.93 75.06 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.437 -178.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.706 ' HB3' ' HZ1' ' B' ' 62' ' ' LYS . 1.6 tt0 169.77 -69.54 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 O-C-N 123.168 0.293 . . . . 0.0 111.364 178.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.627 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER -148.11 114.78 6.01 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.435 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 3.9 m-20 -139.83 87.48 2.17 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.52 ' C ' ' H ' ' A' ' 403' ' ' PHE . 1.3 p30 -138.45 -48.62 0.53 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -67.98 6.89 0.62 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.636 0.732 . . . . 0.0 110.637 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.949 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.56 120.3 7.52 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.766 179.107 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -104.94 131.72 52.08 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.78 -178.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 1.06 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 6.8 pt-20 -137.3 -166.38 1.92 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.225 0.536 . . . . 0.0 111.374 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -138.82 150.68 46.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.662 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -78.86 14.36 1.39 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.928 0.394 . . . . 0.0 111.458 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.459 ' HG3' ' HB3' ' B' ' 52' ' ' CYS . 5.2 pt-20 -50.61 98.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.808 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.72 -41.52 9.65 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 3.3 t0 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.825 178.608 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 7.7 tpt . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 121.162 0.506 . . . . 0.0 109.994 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.08 87.53 1.61 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.2 m 64.85 33.21 10.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 122.028 0.918 . . . . 0.0 108.565 -177.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -143.81 91.59 2.25 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.879 -178.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 4.1 m 61.32 74.77 0.43 Allowed 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.378 0.608 . . . . 0.0 109.536 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.52 2.42 11.23 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.96 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.643 ' CD ' ' H ' ' B' ' 7' ' ' GLU . 0.7 OUTLIER -81.92 101.64 10.38 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.315 -1.311 . . . . 0.0 109.769 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.3 t -82.36 116.27 26.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.126 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 34.7 mt -91.37 -33.3 15.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.181 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.1 tp -131.21 127.48 37.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.992 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 71.1 mt -110.21 124.25 66.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.863 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.4 t -115.65 150.24 17.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.331 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.613 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -115.47 178.0 4.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.3 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.589 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.44 70.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 O-C-N 125.294 1.621 . . . . 0.0 113.245 -178.531 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.613 HG23 ' O ' ' B' ' 13' ' ' LYS . 19.7 t -119.1 131.26 72.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.022 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.707 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 98.9 mtt180 -101.96 139.2 37.92 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.316 0.579 . . . . 0.0 111.301 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.568 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -134.84 109.57 8.61 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.968 -1.014 . . . . 0.0 108.728 179.039 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.95 41.43 6.58 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.477 0.485 . . . . 0.0 110.914 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.554 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 4.1 tptp 73.95 27.3 1.65 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.548 179.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.707 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 35.8 mt-30 -125.82 124.24 40.49 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -85.78 139.36 31.38 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.013 0.196 . . . . 0.0 110.798 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.575 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -172.96 -153.71 9.74 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.51 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.29 137.85 52.93 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.948 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.61 142.28 33.21 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.736 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -136.44 120.68 17.9 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.875 HD11 HG13 ' B' ' 92' ' ' VAL . 15.2 mt -100.27 120.66 40.26 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.636 -0.425 . . . . 0.0 111.28 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.57 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.6 mpt? -96.51 166.91 11.46 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.12 66.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -116.62 -0.89 12.28 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.463 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 16.8 ptt180 -157.13 158.69 36.81 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 119.158 -1.017 . . . . 0.0 112.699 -177.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 1.003 HD13 HD11 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -110.39 121.62 63.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.73 178.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.85 150.43 42.88 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.038 0.447 . . . . 0.0 110.662 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.948 ' HB2' HD12 ' B' ' 24' ' ' LEU . 31.1 t90 -146.99 139.83 25.1 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -131.1 137.52 30.88 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.461 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.575 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 22.1 Cg_exo -64.52 160.93 37.27 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.515 2.143 . . . . 0.0 111.515 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -59.44 131.26 50.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.191 0.519 . . . . 0.0 111.358 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.01 29.85 68.51 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.078 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 21.8 mmtm -113.7 147.55 37.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 117.023 0.412 . . . . 0.0 110.46 179.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -96.32 -14.65 22.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.044 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -124.02 146.7 48.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.45 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.421 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 45.4 m-85 -83.57 121.83 27.76 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.818 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . 0.4 ' OG1' ' HD3' ' B' ' 35' ' ' PRO . 1.1 p -83.81 -21.13 32.2 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.262 0.553 . . . . 0.0 110.411 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.789 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 10.3 mm -106.28 124.39 61.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.56 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 42.3 t -147.78 101.45 3.32 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.827 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.516 ' CD2' HG23 ' B' ' 43' ' ' ILE . 73.4 m-70 -129.94 139.13 51.15 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.52 ' O ' HG12 ' B' ' 50' ' ' ILE . 79.6 mmm -92.4 142.77 27.06 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.698 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.7 m-85 -59.18 -21.3 59.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.25 0.548 . . . . 0.0 109.817 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . 0.594 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -68.38 -22.75 64.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.144 -0.935 . . . . 0.0 112.185 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.557 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -102.54 -10.92 18.91 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.999 0.428 . . . . 0.0 110.771 -179.426 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.678 ' HB ' HD22 ' B' ' 100' ' ' LEU . 0.9 OUTLIER -86.35 132.45 32.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.678 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -92.72 -55.34 3.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.609 0.719 . . . . 0.0 109.964 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.497 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -144.52 -177.45 5.5 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . 0.648 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 6.3 pt20 -141.87 145.85 35.1 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.694 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.069 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 49.3 mttp -107.16 147.05 30.59 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 177.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.732 ' HB ' ' HD3' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.92 123.46 62.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 176.365 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -88.97 120.27 69.94 Favored Pre-proline 0 C--O 1.245 0.868 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -69.53 172.69 11.96 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 124.415 3.41 . . . . 0.0 113.968 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.46 161.29 12.04 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.203 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.85 -28.96 7.75 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.627 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 6.4 mttp -85.24 161.36 19.6 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 175.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.02 -16.75 64.18 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.357 0.599 . . . . 0.0 110.496 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.706 ' HZ1' ' HB3' ' A' ' 398' ' ' GLU . 0.0 OUTLIER -140.05 150.37 44.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.415 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.603 ' O ' ' HB2' ' B' ' 79' ' ' PHE . 4.1 mp -89.11 135.09 26.73 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.41 HE21 ' HB2' ' B' ' 64' ' ' GLN . 7.0 mt-30 -134.35 162.95 30.79 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -175.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.756 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -140.0 153.62 46.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.06 -1.427 . . . . 0.0 107.968 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.069 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.45 145.51 30.24 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 119.232 0.924 . . . . 0.0 110.72 178.26 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 1.003 HD11 HD13 ' B' ' 31' ' ' ILE . 95.6 mt -94.74 109.08 21.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.421 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.536 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.0 t -95.36 108.72 21.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.53 HD22 HD13 ' B' ' 50' ' ' ILE . 5.2 mt -88.77 155.83 19.33 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.102 -177.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.557 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -79.23 -1.58 37.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.666 0.746 . . . . 0.0 109.034 178.294 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -5.91 58.71 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.584 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.5 20.45 44.65 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.556 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.525 ' HB3' HD12 ' B' ' 69' ' ' LEU . 19.1 t70 -126.14 160.86 29.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.62 -0.29 . . . . 0.0 110.279 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.536 HG22 ' HA ' ' B' ' 68' ' ' VAL . 17.5 p -138.23 131.21 29.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.459 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.535 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.8 m -110.46 102.77 11.35 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.817 ' HB2' ' HG2' ' A' ' 395' ' ' GLU . 3.2 m-20 -82.99 144.63 29.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.552 0.691 . . . . 0.0 112.303 -177.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.789 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 46.5 m-85 -129.59 107.32 9.36 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.876 -1.056 . . . . 0.0 109.564 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.575 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t-160 -86.98 112.43 21.82 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.639 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.756 ' HE1' ' HB2' ' B' ' 65' ' ' LEU . 81.3 m-85 -83.56 95.98 8.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.92 5.47 51.56 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.589 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.4 t-20 -87.23 91.45 8.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.915 0.388 . . . . 0.0 110.015 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.06 -39.28 9.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.923 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.91 -59.44 4.33 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.53 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.61 10.41 6.64 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -44.99 -48.5 11.47 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.506 HG22 HG12 ' B' ' 63' ' ' ILE . 4.8 t -57.63 -52.14 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.15 0.5 . . . . 0.0 110.685 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.6 mttt -68.72 -33.63 74.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.61 ' HB3' ' CE2' ' B' ' 79' ' ' PHE . 11.3 mt-10 -65.79 -43.53 88.49 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.732 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 6.1 ttm105 -57.73 -43.71 85.51 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 177.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.22 -44.76 87.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.289 -1.323 . . . . 0.0 112.758 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.06 -45.11 74.77 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 117.784 0.266 . . . . 0.0 111.451 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.875 HG13 HD11 ' B' ' 26' ' ' LEU . 44.4 t -60.69 -43.19 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.648 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 1.4 ttpm? -59.27 -55.01 40.33 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.821 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -53.84 -54.33 39.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.474 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.637 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.2 tp -61.76 -41.71 98.05 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.349 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.488 HD12 HG12 ' B' ' 92' ' ' VAL . 22.1 mt -69.29 -44.62 71.42 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 117.876 0.307 . . . . 0.0 110.221 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.511 ' N ' HE22 ' B' ' 53' ' ' GLN . 5.8 tp-100 -62.0 -24.28 66.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.233 1.016 . . . . 0.0 109.079 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.464 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 2.0 mm-40 -84.97 -44.76 12.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.299 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.67 HD13 ' CE2' ' B' ' 47' ' ' TYR . 20.4 mt -81.06 -47.07 14.05 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.698 HD23 ' HB3' ' B' ' 47' ' ' TYR . 34.6 mt -50.15 -56.77 15.64 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -176.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 52.4 Cg_exo -57.09 -22.32 46.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.407 2.071 . . . . 0.0 114.094 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.464 ' HD3' ' O ' ' B' ' 98' ' ' GLN . 12.2 mtpt -88.53 -10.93 47.2 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.594 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 71.4 m-85 -127.08 7.94 6.64 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.677 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.53 ' O ' ' HD2' ' B' ' 104' ' ' LYS . 0.0 OUTLIER -55.05 128.23 32.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.17 0.509 . . . . 0.0 112.034 -179.127 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 41.0 mtt-85 58.85 21.35 8.97 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.302 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.437 ' HE3' ' HB3' ' B' ' 106' ' ' LYS . 0.7 OUTLIER -83.23 78.89 9.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.972 0.415 . . . . 0.0 110.147 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -81.18 55.28 2.48 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.958 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.075 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.516 ' CE2' ' HB3' ' A' ' 396' ' ' ASP . 5.2 t80 . . . . . 0 N--CA 1.476 0.864 0 CA-C-O 121.392 0.615 . . . . 0.0 110.316 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 50.7 t -132.75 115.87 25.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 81.83 -57.67 4.93 Favored Glycine 0 N--CA 1.45 -0.405 0 N-CA-C 109.829 -1.309 . . . . 0.0 109.829 -177.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.604 ' HG2' ' HB2' ' B' ' 76' ' ' ASN . 7.8 tp10 -111.95 148.31 34.02 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.56 ' C ' ' H ' ' A' ' 398' ' ' GLU . 3.3 p30 -109.16 30.14 6.86 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.714 -0.221 . . . . 0.0 111.5 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.535 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 0.8 OUTLIER -64.3 16.88 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.641 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.56 ' H ' ' C ' ' A' ' 396' ' ' ASP . 47.1 mt-10 96.16 -77.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.606 1.562 . . . . 0.0 111.906 178.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.918 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.0 OUTLIER -108.97 143.85 37.7 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.316 -177.807 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 177.7 77.12 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.052 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.555 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.04 -54.2 0.58 Allowed 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -177.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . 0.416 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 3.9 p30 -69.9 11.5 0.29 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.728 0.775 . . . . 0.0 110.555 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 1.013 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.53 126.28 25.85 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.858 179.352 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -112.92 122.34 47.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.714 -178.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.592 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 3.2 pt-20 -107.28 -29.96 9.0 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.065 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 79.23 -37.02 0.18 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.769 0.828 . . . . 0.0 110.545 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -78.6 -35.21 46.04 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.403 ' HB2' ' H ' ' A' ' 409' ' ' ASP . 5.9 mm-40 51.84 -103.04 0.14 Allowed 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.316 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.403 ' H ' ' HB2' ' A' ' 408' ' ' GLU . 1.1 t0 -178.82 152.71 0.61 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.492 -0.776 . . . . 0.0 108.93 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 27.7 t70 . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.659 -0.686 . . . . 0.0 109.769 -179.23 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.492 ' H2 ' ' CD ' ' B' ' 7' ' ' GLU . 77.7 mtm . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 120.512 0.196 . . . . 0.0 111.019 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.23 127.75 0.35 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.28 51.97 0.57 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.351 0.596 . . . . 0.0 111.586 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -158.38 -47.24 0.06 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.309 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 14.8 m -155.28 154.66 32.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.321 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 67.82 42.77 1.88 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.464 0.65 . . . . 0.0 110.374 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.492 ' CD ' ' H2 ' ' B' ' 1' ' ' MET . 1.4 tp10 -106.32 122.72 46.81 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.37 178.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' B' ' 27' ' ' MET . 49.0 t -82.89 121.8 36.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 115.217 -0.902 . . . . 0.0 111.605 -177.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.1 mt -97.37 -30.39 12.96 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.476 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 8.5 tp -131.76 127.31 36.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.837 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 75.8 mt -111.78 121.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.825 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -111.21 149.9 13.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.215 -179.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.586 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.4 mtmp? -115.65 176.94 4.86 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.841 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.546 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.0 mtpm? 18.17 72.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 O-C-N 125.352 1.657 . . . . 0.0 113.527 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.586 HG23 ' O ' ' B' ' 13' ' ' LYS . 18.6 t -119.83 124.52 72.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.577 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.581 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 4.8 mtp180 -89.19 120.21 30.37 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.179 0.514 . . . . 0.0 111.252 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.631 ' HG2' HG13 ' B' ' 43' ' ' ILE . 28.1 tp60 -120.37 115.12 22.9 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 177.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.21 37.57 2.08 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -179.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.529 ' HD3' ' HA ' ' A' ' 397' ' ' ASP . 0.0 OUTLIER 68.24 23.81 7.68 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.336 179.882 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.539 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.2 tt0 -126.21 120.77 30.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.326 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.57 153.29 43.03 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.758 0.313 . . . . 0.0 111.808 -178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.43 ' HA2' ' N ' ' B' ' 36' ' ' GLU . . . 178.08 -154.9 15.83 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.783 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.98 132.87 49.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.997 0.427 . . . . 0.0 110.387 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.7 tp -99.01 143.13 29.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.54 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -134.28 124.42 25.85 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.951 HD11 HG13 ' B' ' 92' ' ' VAL . 17.3 mt -105.13 110.17 22.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.349 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.439 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.2 mpt? -89.46 162.58 15.66 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.47 -23.64 62.9 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -116.23 -12.56 11.16 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -159.57 166.64 30.34 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 119.703 -0.799 . . . . 0.0 112.73 -176.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 1.031 HD13 HD11 ' B' ' 67' ' ' LEU . 1.1 tt -112.21 119.41 60.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.835 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -120.16 151.89 38.44 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.328 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.889 ' HB2' HD12 ' B' ' 24' ' ' LEU . 27.1 t90 -146.9 139.77 25.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -124.76 143.87 44.94 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.274 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.537 ' O ' ' HB2' ' B' ' 38' ' ' LYS . 28.3 Cg_exo -61.85 159.95 31.28 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.476 2.118 . . . . 0.0 111.662 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.43 ' N ' ' HA2' ' B' ' 22' ' ' GLY . 5.3 tp10 -57.34 130.52 46.6 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.21 0.529 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.0 29.81 75.75 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.031 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.15 151.28 31.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.056 0.428 . . . . 0.0 110.843 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -98.65 -22.08 16.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.013 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.405 ' H ' ' HG2' ' B' ' 40' ' ' ARG . 6.5 ptp180 -108.67 140.92 41.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.651 -178.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -84.74 124.59 31.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.011 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.4 p -92.58 -13.65 29.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.281 0.562 . . . . 0.0 110.594 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.739 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -114.09 124.89 71.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.135 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.0 t -147.81 102.84 3.45 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -124.5 137.41 54.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.488 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.7 mmm -89.16 138.89 31.02 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.694 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.7 m-85 -56.97 -24.39 52.82 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.301 0.572 . . . . 0.0 110.358 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.27 -32.65 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.614 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.571 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -91.58 -11.87 36.0 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 123.538 0.524 . . . . 0.0 111.604 -178.272 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.626 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.5 mm -83.57 135.69 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.413 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 18.0 ttpp -87.18 -47.69 8.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 4.7 p -167.73 -177.77 3.6 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.318 -1.31 . . . . 0.0 108.273 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -135.05 144.04 47.05 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.616 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.013 ' HD3' ' HB3' ' A' ' 403' ' ' PHE . 48.1 mttp -102.16 148.31 25.56 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.535 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -125.78 127.84 71.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 176.542 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.434 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.9 p -91.3 115.62 64.78 Favored Pre-proline 0 C--O 1.25 1.111 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 59.7 Cg_endo -67.6 173.14 9.36 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 125.125 3.883 . . . . 0.0 114.042 -177.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -59.28 160.05 7.01 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.123 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.52 -29.05 8.13 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.534 -1.427 . . . . 0.0 109.534 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.596 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 5.1 mttm -86.9 153.18 21.81 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.37 -16.21 64.12 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.242 0.544 . . . . 0.0 110.493 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.918 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.31 138.38 38.31 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.926 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.63 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -80.34 131.61 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.54 162.91 30.96 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -176.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.689 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.6 tp -140.38 153.89 46.52 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.068 -1.424 . . . . 0.0 107.719 177.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.005 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -145.7 142.43 28.98 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.973 0.806 . . . . 0.0 110.483 178.176 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 1.031 HD11 HD13 ' B' ' 31' ' ' ILE . 39.8 mt -94.0 106.94 18.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.024 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.515 HG21 ' OE2' ' A' ' 405' ' ' GLU . 8.1 t -94.24 113.84 29.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.042 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.542 HD22 HD13 ' B' ' 50' ' ' ILE . 3.2 mt -98.36 158.9 15.3 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.021 0.439 . . . . 0.0 112.066 -177.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.571 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -81.18 0.02 38.38 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.297 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.67 -3.47 56.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.531 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.91 19.96 56.68 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.42 ' HB3' HD12 ' B' ' 69' ' ' LEU . 18.9 t70 -126.04 157.41 38.01 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.559 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' B' ' 67' ' ' LEU . 20.3 p -137.15 130.86 31.74 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.524 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 0.8 OUTLIER -107.96 105.34 15.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.157 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.604 ' HB2' ' HG2' ' A' ' 395' ' ' GLU . 5.2 m-20 -86.36 128.46 34.94 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 112.534 -177.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.739 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 50.3 m-85 -114.32 110.03 19.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.397 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.581 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.5 t-160 -86.82 113.35 22.56 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.026 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.689 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 46.0 m-85 -80.18 92.33 5.68 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.31 27.66 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.926 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.546 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -107.14 91.33 3.61 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -35.51 4.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.19 -0.914 . . . . 0.0 113.337 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 57.1 m -58.88 -59.99 4.57 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.516 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 17.8 p -127.9 9.99 6.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -176.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.596 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -42.8 -50.15 5.68 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 113.863 1.061 . . . . 0.0 113.863 -177.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.462 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.92 -52.79 53.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.909 0.385 . . . . 0.0 110.992 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.516 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -66.73 -35.49 80.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.138 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.643 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.3 mt-10 -64.97 -45.46 85.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.63 ' HD3' HG23 ' B' ' 63' ' ' ILE . 20.6 ttp180 -55.22 -47.51 75.24 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.5 -45.27 93.77 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.799 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.7 -42.44 82.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 117.843 0.292 . . . . 0.0 111.26 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.951 HG13 HD11 ' B' ' 26' ' ' LEU . 45.8 t -62.36 -42.26 94.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -53.46 58.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.69 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . 0.419 ' HA ' ' HG2' ' B' ' 97' ' ' GLN . 2.9 m-20 -57.82 -54.65 44.46 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.045 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.824 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -60.67 -40.33 91.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.137 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.493 HD12 HG12 ' B' ' 92' ' ' VAL . 22.7 mt -69.72 -45.86 67.24 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.729 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.419 ' HG2' ' HA ' ' B' ' 94' ' ' ASP . 19.4 pt20 -65.03 -18.39 65.26 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.745 0.783 . . . . 0.0 109.544 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.448 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 33.4 mm-40 -84.79 -50.86 7.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.981 178.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.824 HD12 ' HG ' ' B' ' 95' ' ' LEU . 9.3 mt -78.41 -45.91 21.18 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.694 HD23 ' HB3' ' B' ' 47' ' ' TYR . 32.7 mt -51.58 -51.23 71.58 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -176.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 45.4 Cg_endo -67.36 -24.96 42.57 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 122.198 1.932 . . . . 0.0 114.341 -178.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 32.3 mttm -63.82 -31.67 72.93 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.003 0.43 . . . . 0.0 111.804 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -91.79 17.19 9.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.665 0.745 . . . . 0.0 110.485 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.407 ' HD3' ' O ' ' B' ' 100' ' ' LEU . 14.4 mptt -112.55 -177.84 3.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.775 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.575 ' HA ' ' HE ' ' B' ' 105' ' ' ARG . 0.0 OUTLIER -89.02 46.59 1.4 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.196 0.522 . . . . 0.0 110.748 179.841 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -156.37 110.85 2.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.599 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.13 119.04 7.08 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.546 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.519 -0.753 . . . . 0.0 109.859 -179.488 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.529 ' HE2' ' HB2' ' A' ' 395' ' ' GLU . 2.6 p90 . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.642 0.258 . . . . 0.0 110.457 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 21.1 t -94.89 99.97 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.157 0.503 . . . . 0.0 109.8 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 170.56 -45.33 0.2 Allowed Glycine 0 CA--C 1.505 -0.531 0 N-CA-C 109.444 -1.463 . . . . 0.0 109.444 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.529 ' HB2' ' HE2' ' A' ' 392' ' ' TYR . 0.0 OUTLIER -117.16 169.35 9.52 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 177.187 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.42 ' O ' ' HE3' ' B' ' 19' ' ' LYS . 32.1 t70 -136.1 31.86 2.93 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.298 -178.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.652 ' HA ' ' HA ' ' B' ' 18' ' ' LYS . 32.1 t70 -60.35 -42.57 96.03 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.602 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.832 ' HB2' ' HZ3' ' B' ' 62' ' ' LYS . 0.5 OUTLIER 165.25 -84.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.161 0.984 . . . . 0.0 108.582 179.016 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.45 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 5.3 pt-20 -125.99 109.53 12.55 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 176.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.492 ' HB3' ' HE1' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.5 87.19 2.24 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.17 -176.799 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.526 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -138.75 -50.31 0.54 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.287 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.33 13.63 0.42 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.546 0.688 . . . . 0.0 110.264 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.92 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -56.62 127.51 31.74 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.144 179.014 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -99.65 131.51 45.6 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.896 -178.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.909 ' HB2' ' HG2' ' B' ' 54' ' ' LYS . 8.7 tt0 -136.33 132.93 36.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.683 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 405' ' ' GLU . 2.4 t30 175.58 45.63 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 123.986 0.804 . . . . 0.0 109.504 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . 0.401 ' OD2' ' HG2' ' B' ' 97' ' ' GLN . 10.1 t0 -77.76 -35.37 51.8 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.35 -170.02 0.21 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.714 -179.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.558 ' HA ' ' NZ ' ' B' ' 51' ' ' LYS . 40.9 t0 -175.07 57.98 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.213 176.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 4.9 t70 . . . . . 0 C--O 1.255 1.354 0 CA-C-N 114.264 -1.335 . . . . 0.0 109.118 -179.85 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.652 ' HG2' ' HB1' ' B' ' 28' ' ' ALA . 3.0 ptm . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 120.296 0.093 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.86 -50.6 9.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.985 0.421 . . . . 0.0 110.644 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 6.0 m -130.27 -30.71 1.92 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.255 0.55 . . . . 0.0 110.349 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 53.4 m -151.26 -153.36 0.48 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.062 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 5.2 m -116.66 169.74 9.12 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 66.13 25.25 10.79 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.654 0.596 . . . . 0.0 110.581 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' B' ' 27' ' ' MET . 91.2 mt-10 -74.09 101.41 3.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.478 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.6 t -82.75 106.54 13.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.443 ' HB2' HD21 ' B' ' 95' ' ' LEU . 19.5 mt -88.28 -28.85 20.82 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.486 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.411 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -135.61 136.85 41.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.9 mt -121.66 120.14 60.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.797 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.5 t -110.89 150.02 13.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.463 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.548 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.1 mtmp? -116.4 175.89 5.35 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.406 -178.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.48 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.3 OUTLIER 17.87 70.9 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.679 0 O-C-N 125.346 1.654 . . . . 0.0 113.293 -178.527 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.548 HG23 ' O ' ' B' ' 13' ' ' LYS . 11.7 t -114.92 121.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.073 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.575 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 73.4 mtp85 -92.49 120.92 33.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.414 HE21 ' HB3' ' B' ' 17' ' ' GLN . 0.6 OUTLIER -113.27 103.37 11.25 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 178.311 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.652 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 57.5 mttp 63.76 56.44 1.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.076 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.547 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 0.3 OUTLIER 68.51 21.23 8.19 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.765 177.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.575 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tt0 -133.7 122.6 23.61 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.831 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.03 153.44 43.2 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.92 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.668 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 177.98 -170.75 43.13 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 116.148 -0.478 . . . . 0.0 112.706 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 131.74 54.04 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.938 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.31 139.1 33.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.542 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . 0.457 ' CD2' ' HE1' ' B' ' 41' ' ' PHE . 71.3 m-85 -132.7 122.75 25.08 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.908 HD11 HG13 ' B' ' 92' ' ' VAL . 14.0 mt -102.11 116.43 32.66 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.458 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.553 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 1.8 mpt? -93.99 162.45 13.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.652 ' HB1' ' HG2' ' B' ' 1' ' ' MET . . . -62.44 -8.76 6.66 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.494 ' HG3' ' HB3' ' B' ' 1' ' ' MET . 5.3 mp0 -127.9 -16.13 4.7 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -158.24 160.5 37.19 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.439 -176.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 1.018 HD13 HD11 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.37 118.66 53.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.416 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -119.14 154.17 33.69 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.415 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.938 ' HB2' HD12 ' B' ' 24' ' ' LEU . 55.2 t90 -146.87 129.42 15.96 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.401 ' HB2' ' CD1' ' B' ' 41' ' ' PHE . . . -109.96 121.82 40.77 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.312 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.445 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 40.3 Cg_endo -69.03 139.46 42.82 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.469 2.112 . . . . 0.0 111.833 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.668 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.0 mt-10 -57.92 132.04 52.22 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.628 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.09 -7.48 64.53 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.141 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -113.37 152.94 29.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.583 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -97.55 -7.32 31.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.36 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -124.24 152.02 43.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.109 0.48 . . . . 0.0 111.938 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.457 ' HE1' ' CD2' ' B' ' 25' ' ' TYR . 44.8 m-85 -81.16 121.81 26.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.901 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 12.7 p -91.46 -9.85 43.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 110.111 179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.79 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 19.0 mm -117.34 119.99 63.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.159 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 27.7 t -148.04 101.43 3.29 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.482 ' CD2' HG23 ' B' ' 43' ' ' ILE . 66.0 m-70 -125.99 132.95 51.93 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.49 ' O ' HG12 ' B' ' 50' ' ' ILE . 50.9 mtp -86.6 143.38 27.68 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.676 ' HB3' HD23 ' B' ' 100' ' ' LEU . 19.9 m-85 -59.92 -22.09 61.97 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.195 0.521 . . . . 0.0 109.959 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.86 -3.31 31.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.707 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.559 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 12.4 m-20 -118.78 -9.99 10.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.252 0.549 . . . . 0.0 110.105 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.804 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.3 mm -92.39 127.7 44.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.558 ' NZ ' ' HA ' ' A' ' 409' ' ' ASP . 29.1 tttp -87.15 -49.49 7.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.477 0.656 . . . . 0.0 110.069 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.08 -177.43 5.91 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.188 -178.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . 0.43 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 24.3 pt20 -144.49 146.78 32.6 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.969 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.086 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 39.3 mttp -109.06 146.18 34.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 177.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.536 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -125.11 128.54 73.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 176.211 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -90.87 118.66 68.77 Favored Pre-proline 0 C--O 1.25 1.105 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -178.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.55 173.03 13.14 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 125.196 3.931 . . . . 0.0 114.017 -177.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -61.35 160.24 11.12 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.79 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.84 -28.97 8.09 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -177.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 3.6 mttm -87.41 164.78 16.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.44 -14.96 57.86 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.314 0.578 . . . . 0.0 109.924 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.832 ' HZ3' ' HB2' ' A' ' 398' ' ' GLU . 0.0 OUTLIER -133.46 129.79 37.72 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.445 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.442 HG21 ' HA ' ' B' ' 86' ' ' VAL . 2.7 mp -77.98 129.6 37.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 177.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -135.67 163.63 29.71 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.701 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.8 tp -138.84 153.43 48.34 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 113.069 -1.878 . . . . 0.0 106.906 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.086 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -146.32 140.98 26.83 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 119.07 0.85 . . . . 0.0 110.33 178.336 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 1.018 HD11 HD13 ' B' ' 31' ' ' ILE . 94.3 mt -94.02 111.22 22.91 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.444 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.621 ' HA ' HG22 ' B' ' 74' ' ' THR . 15.0 t -95.73 102.83 14.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.719 HD22 HD13 ' B' ' 50' ' ' ILE . 1.3 mt -84.06 152.89 24.11 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.942 -176.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.559 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 1.6 p-80 -81.38 6.4 14.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.695 0.759 . . . . 0.0 109.004 178.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.82 -22.04 46.79 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.311 -1.313 . . . . 0.0 109.226 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.93 4.51 24.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.184 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.522 ' OD2' HD12 ' B' ' 69' ' ' LEU . 4.5 p-10 -126.65 175.95 7.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.075 0.464 . . . . 0.0 111.807 -179.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.621 HG22 ' HA ' ' B' ' 68' ' ' VAL . 14.2 p -136.85 146.83 46.06 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.066 -179.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.545 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 18.6 m -122.24 103.47 8.79 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.108 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.541 ' HB2' ' HB2' ' A' ' 397' ' ' ASP . 6.8 m-20 -81.98 150.86 27.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.265 0.555 . . . . 0.0 112.273 -178.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.79 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.5 m-85 -137.34 117.85 13.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.31 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.644 ' HB2' ' HZ1' ' B' ' 62' ' ' LYS . 4.5 t-160 -92.15 113.69 26.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.708 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.701 ' HE2' ' HB2' ' B' ' 65' ' ' LEU . 65.2 m-85 -83.7 93.16 7.86 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.71 3.48 53.84 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.48 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.9 t-20 -85.1 91.19 8.05 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.09 -41.9 2.76 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.427 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.35 -59.84 3.58 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 20.8 p -127.78 7.93 6.25 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -176.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.506 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -41.1 -52.89 3.17 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.442 ' HA ' HG21 ' B' ' 63' ' ' ILE . 2.2 t -57.67 -49.11 81.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.544 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 5.8 mptt -70.06 -31.95 69.82 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.636 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.2 mt-10 -65.92 -44.1 86.15 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.482 ' HD2' HD12 ' B' ' 55' ' ' ILE . 23.4 ttp180 -56.51 -47.56 79.05 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . 0.672 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -63.39 -44.69 93.98 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.38 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.63 -44.13 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.884 0.311 . . . . 0.0 111.424 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.908 HG13 HD11 ' B' ' 26' ' ' LEU . 57.0 t -59.81 -45.11 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.672 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.6 tmmt? -58.55 -54.56 45.72 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.007 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.07 -54.43 30.38 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.101 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.872 ' HG ' HD12 ' B' ' 99' ' ' LEU . 14.8 tp -65.29 -30.6 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.025 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.449 HD12 HG12 ' B' ' 92' ' ' VAL . 24.0 mt -76.18 -42.58 45.91 Favored 'General case' 0 C--O 1.216 -0.676 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.401 ' HG2' ' OD2' ' A' ' 407' ' ' ASP . 26.4 mt-30 -60.81 -24.52 65.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.379 1.085 . . . . 0.0 108.745 178.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.98 -46.62 11.86 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.551 -1.659 . . . . 0.0 111.363 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.872 HD12 ' HG ' ' B' ' 95' ' ' LEU . 11.5 mt -86.78 -28.11 23.18 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -176.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.804 HD22 ' HB ' ' B' ' 50' ' ' ILE . 28.3 mt -67.57 -58.64 8.15 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.0 -21.67 72.81 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.888 1.725 . . . . 0.0 112.993 -178.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.522 ' HG2' ' HA ' ' B' ' 99' ' ' LEU . 3.8 ptmm? -87.91 2.2 52.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.598 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.475 ' HD2' ' O ' ' B' ' 99' ' ' LEU . 11.2 m-85 -127.66 -34.76 2.18 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -31.36 114.49 0.13 Allowed 'General case' 0 N--CA 1.477 0.889 0 O-C-N 124.031 0.832 . . . . 0.0 112.924 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 23.0 ttm105 -70.54 -30.57 67.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.892 -1.049 . . . . 0.0 112.457 -177.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.475 ' HZ2' ' HB2' ' B' ' 70' ' ' HIS . 0.0 OUTLIER -146.3 158.64 43.9 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.734 -0.387 . . . . 0.0 111.019 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -91.11 150.27 21.46 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.962 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 1.02 0 O-C-N 124.088 0.868 . . . . 0.0 111.27 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 1.9 p90 . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 27.7 t -67.3 127.59 29.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 94.54 -79.48 0.92 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.401 ' HG3' ' ND2' ' B' ' 76' ' ' ASN . 1.2 tm-20 -92.06 123.37 35.37 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 398' ' ' GLU . 6.2 p-10 -89.23 -1.39 58.06 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.604 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 3.5 t70 -70.25 15.83 0.08 Allowed 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.22 0.464 . . . . 0.0 111.938 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.604 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 0.8 OUTLIER 98.85 -93.1 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.343 1.457 . . . . 0.0 112.147 178.523 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.734 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 20.9 tt0 -123.7 117.88 25.97 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 122.058 0.143 . . . . 0.0 111.259 -178.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.566 ' HB3' ' HE2' ' A' ' 403' ' ' PHE . 5.1 m-20 -150.35 82.58 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 403' ' ' PHE . 23.6 p-10 -139.01 -42.31 0.47 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -72.18 15.83 0.15 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.72 0.771 . . . . 0.0 110.93 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 1.088 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -55.86 132.31 49.21 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.693 179.307 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -115.45 127.79 55.58 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.369 -178.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.845 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 4.2 pt-20 -136.61 147.82 47.15 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -135.76 59.53 1.71 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.481 0.658 . . . . 0.0 111.219 -179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . 0.493 ' CB ' ' HB3' ' B' ' 52' ' ' CYS . 8.8 t70 -112.95 -24.86 9.27 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.921 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.23 -99.62 0.09 Allowed 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.231 -179.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.52 ' OD1' ' HE3' ' B' ' 106' ' ' LYS . 35.9 t70 -145.99 77.65 1.5 Allowed 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.734 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' B' ' 106' ' ' LYS . 31.3 t70 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.169 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 67.08 29.83 7.71 Favored 'General case' 0 C--O 1.232 0.176 0 O-C-N 123.891 0.745 . . . . 0.0 110.149 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 1.7 m -78.97 81.26 5.26 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.675 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 6.6 m 69.46 -93.74 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.36 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 35.8 m -159.95 167.1 28.78 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 67.1 26.57 8.84 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.965 0.791 . . . . 0.0 111.389 178.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.431 ' O ' ' HA ' ' B' ' 27' ' ' MET . 27.1 tt0 -104.1 116.92 33.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.044 0.449 . . . . 0.0 110.864 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 90.9 t -82.78 120.73 34.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.126 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.414 ' HB2' HD21 ' B' ' 95' ' ' LEU . 45.3 mt -94.73 -30.36 14.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.618 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.0 tp -136.64 135.11 38.01 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 77.8 mt -118.55 119.55 61.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.722 HG21 HD23 ' B' ' 24' ' ' LEU . 2.8 t -108.46 148.64 12.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.812 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.572 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.11 173.59 6.25 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.114 -178.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 17.75 68.24 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 O-C-N 125.163 1.539 . . . . 0.0 114.214 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.572 HG23 ' O ' ' B' ' 13' ' ' LYS . 24.4 t -117.08 126.85 74.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 177.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.649 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 12.0 mtt180 -99.18 133.64 43.18 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.36 0.6 . . . . 0.0 111.65 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.543 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 4.8 tp-100 -111.21 107.47 16.8 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.53 46.53 1.84 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.733 0.778 . . . . 0.0 109.264 -179.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.35 23.64 9.18 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.896 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.618 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.2 tt0 -122.16 119.19 30.57 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.381 -0.199 . . . . 0.0 110.776 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.498 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 1.2 m-20 -58.85 146.66 36.56 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.709 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . 178.67 -169.39 40.89 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.082 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.28 137.2 53.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.979 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -97.48 137.79 35.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.917 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . 0.416 ' CD1' ' HE2' ' B' ' 41' ' ' PHE . 68.6 m-85 -131.96 117.4 18.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.784 HD11 HG13 ' B' ' 92' ' ' VAL . 12.3 mt -100.42 119.12 37.98 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.501 -178.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.431 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.3 mpt? -95.44 161.85 13.9 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -20.43 63.14 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.54 -22.2 11.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -178.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.507 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 1.6 ptp180 -155.28 160.86 41.11 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.713 -0.795 . . . . 0.0 112.592 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.911 HD12 HD11 ' B' ' 67' ' ' LEU . 0.0 OUTLIER -104.0 122.15 56.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 114.81 -1.086 . . . . 0.0 108.282 179.028 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.403 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -125.84 155.37 41.27 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.182 0.515 . . . . 0.0 111.29 -179.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.979 ' HB2' HD12 ' B' ' 24' ' ' LEU . 50.4 t90 -147.23 134.69 20.83 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.904 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -117.67 133.77 23.27 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.033 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 1.005 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 2.3 Cg_endo -77.14 146.38 25.35 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.377 2.051 . . . . 0.0 111.923 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.709 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 34.3 mt-10 -64.01 129.46 40.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.297 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.45 -0.02 61.35 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.439 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 1.005 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.9 mptt -113.42 154.37 27.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.322 . . . . 0.0 110.768 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -100.94 4.72 42.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.451 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -140.03 157.17 46.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.209 0.528 . . . . 0.0 111.895 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.416 ' HE2' ' CD1' ' B' ' 25' ' ' TYR . 61.2 m-85 -85.21 126.05 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.756 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.7 p -93.07 -19.07 21.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.263 0.554 . . . . 0.0 110.381 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.704 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 37.1 mm -110.71 118.63 57.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.23 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 43.6 t -147.8 101.33 3.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -126.36 138.82 53.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.785 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.512 ' O ' HG12 ' B' ' 50' ' ' ILE . 18.9 mmt -84.33 144.23 28.98 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.676 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.8 m-85 -61.45 -20.6 63.3 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.962 0.41 . . . . 0.0 110.564 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.59 -11.36 60.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.436 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.541 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.05 -11.56 15.28 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.204 0.526 . . . . 0.0 109.655 179.277 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.682 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.2 mm -91.38 131.0 39.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.43 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 34.7 tttm -87.83 -43.38 11.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.359 0.6 . . . . 0.0 109.745 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.505 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.9 p -164.94 -177.59 4.75 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.261 -0.882 . . . . 0.0 109.602 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.67 142.2 41.13 Favored 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.126 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.088 ' HD3' ' HB3' ' A' ' 403' ' ' PHE . 50.2 mttp -105.28 150.89 24.76 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.55 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.95 129.39 71.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.463 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -93.41 121.49 64.97 Favored Pre-proline 0 C--O 1.252 1.21 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -68.15 172.89 10.29 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 125.071 3.847 . . . . 0.0 114.53 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -63.44 160.43 16.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.39 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.75 -29.19 7.97 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.734 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 22.7 mttp -88.47 155.2 19.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.47 -17.69 63.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.974 0.416 . . . . 0.0 110.991 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.607 ' HD3' ' CE1' ' B' ' 78' ' ' HIS . 17.3 pttt -132.47 134.21 44.78 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.731 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.604 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -78.84 134.9 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.63 ' OE1' ' HD3' ' B' ' 60' ' ' LYS . 0.2 OUTLIER -134.0 163.04 30.43 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 118.085 -1.446 . . . . 0.0 114.811 -176.165 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.428 ' HA ' ' O ' ' B' ' 54' ' ' LYS . 2.2 tp -141.95 153.51 44.38 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 113.111 -1.859 . . . . 0.0 107.24 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.033 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.53 141.71 28.51 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 118.93 0.787 . . . . 0.0 110.52 178.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.911 HD11 HD12 ' B' ' 31' ' ' ILE . 96.1 mt -93.83 100.28 12.49 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.884 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.642 ' HA ' HG22 ' B' ' 74' ' ' THR . 11.4 t -86.15 111.88 21.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.467 HD12 ' HB3' ' B' ' 73' ' ' ASP . 6.4 mt -94.26 156.6 16.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.998 0.428 . . . . 0.0 111.543 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.541 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.3 OUTLIER -80.16 -1.4 40.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.248 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.28 -3.96 56.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.542 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.11 19.41 53.23 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.54 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.467 ' HB3' HD12 ' B' ' 69' ' ' LEU . 21.7 t70 -125.96 158.9 34.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.254 . . . . 0.0 110.533 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.642 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.5 p -137.87 131.05 30.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.234 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.547 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.6 m -107.39 103.42 12.76 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.401 ' ND2' ' HG3' ' A' ' 395' ' ' GLU . 3.7 m-20 -82.69 143.85 30.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.072 0.463 . . . . 0.0 112.162 -177.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.704 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 41.6 m-85 -126.64 127.26 44.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.222 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.649 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.5 t-160 -92.37 101.3 13.77 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.178 -178.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.708 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 24.8 m-85 -79.37 99.52 7.19 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.79 9.9 24.69 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.8 91.43 7.05 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.636 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.83 -41.94 1.69 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.451 -178.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.98 -59.75 4.78 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.452 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 18.7 p -127.79 7.34 6.18 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 115.747 1.758 . . . . 0.0 115.747 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.708 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.73 -47.33 7.87 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.4 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.76 -51.44 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-O 120.834 0.349 . . . . 0.0 111.084 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.452 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.5 mptt -69.06 -34.26 74.88 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.053 0.454 . . . . 0.0 109.858 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.687 ' HB3' ' HE2' ' B' ' 79' ' ' PHE . 12.9 mt-10 -64.83 -44.42 89.9 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.604 ' HD3' HG23 ' B' ' 63' ' ' ILE . 24.0 ttp180 -54.91 -47.18 74.7 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 122.052 0.929 . . . . 0.0 108.509 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . 0.603 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.51 -45.37 93.3 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.27 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.54 79.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.689 0.222 . . . . 0.0 111.411 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.784 HG13 HD11 ' B' ' 26' ' ' LEU . 46.8 t -61.69 -41.54 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.603 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.0 OUTLIER -59.87 -58.47 8.42 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.545 177.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.7 -51.42 63.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.937 -1.028 . . . . 0.0 112.31 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.765 ' HG ' HD12 ' B' ' 99' ' ' LEU . 15.5 tp -62.04 -42.61 99.36 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.844 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.461 HD12 HG12 ' B' ' 92' ' ' VAL . 20.7 mt -68.89 -41.03 78.84 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 178.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -64.2 -23.45 67.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 122.094 0.95 . . . . 0.0 109.116 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -84.08 -50.82 7.6 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.237 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.765 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.3 mt -75.25 -49.86 17.95 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 113.47 -1.696 . . . . 0.0 115.103 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.682 HD22 ' HB ' ' B' ' 50' ' ' ILE . 54.6 mt -50.36 -58.41 9.89 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.608 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.9 Cg_exo -54.96 -20.71 23.96 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.19 1.927 . . . . 0.0 113.448 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -88.0 -6.79 57.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.764 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -120.97 -35.63 3.29 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.657 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 0.0 OUTLIER -96.77 145.56 25.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.956 0.407 . . . . 0.0 110.971 -179.629 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' B' ' 105' ' ' ARG . 0.3 OUTLIER -162.43 127.34 3.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.117 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.52 ' HE3' ' OD1' ' A' ' 409' ' ' ASP . 15.5 mtmm -91.34 -156.95 0.47 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.0 19.52 2.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.455 0.645 . . . . 0.0 109.719 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 3.0 t30 . . . . . 0 C--O 1.251 1.145 0 CA-C-N 114.491 -1.231 . . . . 0.0 108.502 -179.642 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.559 ' HB2' ' HA ' ' A' ' 398' ' ' GLU . 82.4 t80 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 111.288 0.107 . . . . 0.0 111.288 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . 0.499 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 86.7 t 80.16 123.68 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -178.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 83.91 -86.65 1.52 Allowed Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.481 ' HA ' ' OE1' ' A' ' 395' ' ' GLU . 4.2 tp10 -99.78 83.84 2.81 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.486 ' O ' ' HE2' ' B' ' 19' ' ' LYS . 0.1 OUTLIER -70.96 30.99 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 -176.159 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.707 ' HB3' ' OD1' ' A' ' 400' ' ' ASP . 8.8 t70 -72.58 -8.95 57.8 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 175.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.606 ' OE2' ' HA ' ' A' ' 398' ' ' GLU . 0.4 OUTLIER 100.18 -14.97 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.496 1.918 . . . . 0.0 114.93 175.609 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.818 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 51.0 tt0 -178.71 92.91 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 118.508 0.595 . . . . 0.0 109.991 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.707 ' OD1' ' HB3' ' A' ' 397' ' ' ASP . 3.5 m-20 -144.95 89.63 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.521 -177.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.507 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.1 OUTLIER -139.0 -48.11 0.49 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -74.39 20.57 0.11 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.694 0.759 . . . . 0.0 111.18 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.655 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.4 OUTLIER -54.37 132.09 43.43 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.328 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -88.8 121.0 30.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.963 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.454 ' HB3' ' CD ' ' A' ' 408' ' ' GLU . 0.8 OUTLIER -91.25 157.48 17.13 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.024 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -165.41 -40.63 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . 0.551 ' HB2' ' OE1' ' B' ' 97' ' ' GLN . 18.6 t70 -91.08 -11.87 37.35 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -177.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.454 ' CD ' ' HB3' ' A' ' 405' ' ' GLU . 1.2 pm0 -58.99 117.04 4.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.1 0.476 . . . . 0.0 111.182 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.1 -95.02 0.09 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.591 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 21.2 t70 . . . . . 0 C--O 1.252 1.206 0 CA-C-O 118.265 -0.874 . . . . 0.0 109.327 179.695 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.182 0 CA-C-O 120.47 0.176 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.24 -43.41 3.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.325 0.584 . . . . 0.0 109.554 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.26 -169.34 1.44 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.636 178.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 9.3 m -56.88 111.16 0.95 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.763 0.316 . . . . 0.0 110.619 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 1.9 p -169.88 36.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.716 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.491 ' HB3' ' NH2' ' B' ' 30' ' ' ARG . 0.1 OUTLIER -176.64 31.2 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.347 0.594 . . . . 0.0 109.646 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.489 ' O ' ' HA ' ' B' ' 27' ' ' MET . 8.9 mp0 -60.93 122.4 14.81 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.388 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.457 HG11 HG12 ' B' ' 11' ' ' ILE . 63.7 t -82.18 108.94 15.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.746 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.41 ' HB2' HD21 ' B' ' 95' ' ' LEU . 31.8 mt -81.3 -33.8 32.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.623 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.401 ' CD2' HG22 ' B' ' 92' ' ' VAL . 6.2 tp -132.11 128.63 38.55 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.457 HG12 HG11 ' B' ' 8' ' ' VAL . 66.3 mt -111.64 122.0 65.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.847 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.6 t -113.57 149.89 15.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.612 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -116.71 179.32 4.04 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.666 -178.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 18.21 66.87 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 O-C-N 125.356 1.66 . . . . 0.0 113.491 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.612 HG23 ' O ' ' B' ' 13' ' ' LYS . 14.9 t -115.05 123.67 70.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.482 179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 54.3 mtt85 -97.44 122.34 40.37 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.233 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.7 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 0.7 OUTLIER -104.84 102.31 11.86 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 178.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.706 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 40.7 mttt 51.53 61.52 3.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.735 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.486 ' HE2' ' O ' ' A' ' 396' ' ' ASP . 0.0 OUTLIER 78.77 12.82 1.39 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 177.457 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.74 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 7.0 pt20 -130.52 125.88 35.41 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.393 0.997 . . . . 0.0 111.007 178.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -80.33 152.74 28.8 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -177.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.419 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . 175.68 -159.17 26.76 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.948 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.23 137.53 52.91 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.944 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -101.21 140.25 35.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.729 -178.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . 0.436 ' CD2' ' HE2' ' B' ' 41' ' ' PHE . 55.4 m-85 -134.83 122.9 22.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.878 HD11 HG13 ' B' ' 92' ' ' VAL . 15.8 mt -103.18 118.01 35.83 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.564 -0.455 . . . . 0.0 111.797 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.489 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 1.8 mpt? -93.36 163.01 13.76 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.08 -21.98 60.07 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -115.25 -15.46 11.61 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.531 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -158.83 166.6 31.52 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 119.744 -0.782 . . . . 0.0 112.892 -177.007 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.863 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -110.23 122.46 64.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.912 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.471 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -124.14 152.81 42.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.085 0.469 . . . . 0.0 110.656 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.944 ' HB2' HD12 ' B' ' 24' ' ' LEU . 25.2 t90 -146.96 140.08 25.32 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -128.82 140.0 37.27 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.522 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.875 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 22.0 Cg_exo -64.02 158.48 47.39 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.625 2.217 . . . . 0.0 111.752 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.23 122.03 11.51 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.383 0.611 . . . . 0.0 111.967 -178.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.36 29.73 59.64 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.308 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.875 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.48 146.72 39.14 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.046 0.423 . . . . 0.0 110.295 178.837 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -92.91 -20.75 20.33 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.938 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -113.18 144.43 42.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.48 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.436 ' HE2' ' CD2' ' B' ' 25' ' ' TYR . 84.5 m-85 -85.74 122.43 29.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.727 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.82 -17.5 33.27 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.351 0.596 . . . . 0.0 110.278 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.707 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 21.4 mm -112.64 119.86 61.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.153 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 32.0 t -148.0 101.45 3.29 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.479 ' CD2' HG23 ' B' ' 43' ' ' ILE . 61.6 m-70 -126.59 131.09 51.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.669 0.271 . . . . 0.0 110.282 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.531 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 67.8 mmm -83.36 143.12 30.54 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.646 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.87 -24.21 56.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.025 0.441 . . . . 0.0 110.571 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.16 -9.03 58.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.922 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.615 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 34.7 m-20 -109.92 -8.83 14.81 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.214 0.53 . . . . 0.0 110.039 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.556 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.0 OUTLIER -88.28 129.47 39.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.049 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.435 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 31.0 tttp -86.01 -38.72 17.6 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.657 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 7.3 p -167.24 178.81 5.39 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.513 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . 0.422 HE22 ' HG3' ' B' ' 93' ' ' LYS . 1.9 pp0? -142.41 135.82 28.91 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.416 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.006 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 34.0 mttm -105.79 155.5 19.23 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.001 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.541 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -128.12 129.99 69.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 176.453 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.42 122.37 63.05 Favored Pre-proline 0 C--O 1.25 1.107 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.661 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.21 172.89 11.3 Favored 'Trans proline' 0 C--O 1.235 0.342 1 C-N-CA 125.48 4.12 . . . . 0.0 114.657 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -65.14 160.41 21.3 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.824 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.42 -28.99 8.21 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.818 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 7.5 mttp -85.76 162.38 18.74 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 177.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.98 -17.73 60.49 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.114 0.483 . . . . 0.0 110.331 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.661 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 13.8 pttp -135.16 133.89 39.61 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.149 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.558 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.1 mp -79.58 129.91 36.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.649 ' HG2' ' HZ2' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -133.13 163.68 28.73 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -175.11 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.524 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -139.37 153.02 47.59 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 112.963 -1.926 . . . . 0.0 106.432 176.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.006 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.1 135.33 22.82 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 119.405 1.002 . . . . 0.0 111.545 179.408 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.863 HD11 HD13 ' B' ' 31' ' ' ILE . 76.7 mt -93.72 99.18 11.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.289 -0.868 . . . . 0.0 109.477 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.657 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.2 t -85.11 105.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.476 HD22 HD13 ' B' ' 50' ' ' ILE . 4.3 mt -89.88 155.7 18.97 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.146 0.498 . . . . 0.0 112.08 -177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.615 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.5 OUTLIER -81.4 4.32 21.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.718 0.771 . . . . 0.0 109.002 177.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -86.27 -5.84 59.1 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.206 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.46 13.96 56.33 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.095 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -126.27 155.14 42.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.761 0.315 . . . . 0.0 110.848 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.585 HG22 ' HA ' ' B' ' 68' ' ' VAL . 10.0 p -127.37 131.23 50.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.521 179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.557 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.9 m -106.84 98.75 8.38 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.787 0.327 . . . . 0.0 110.16 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.485 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.7 m-20 -86.29 147.95 25.84 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.096 0.474 . . . . 0.0 111.381 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.707 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 61.4 m-85 -131.9 116.57 17.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.691 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.541 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.9 t-160 -86.95 103.48 15.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.61 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.684 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 51.2 m-85 -76.5 96.91 4.19 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.96 19.53 20.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.44 ' HA ' HD22 ' B' ' 81' ' ' ASN . 1.0 OUTLIER -90.91 93.6 9.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.291 0.567 . . . . 0.0 109.589 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.76 -32.64 0.63 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.01 -59.47 2.89 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.526 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.5 p -127.39 10.86 6.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -176.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.684 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.39 -52.1 6.12 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.442 HG22 HG12 ' B' ' 63' ' ' ILE . 2.2 t -57.75 -50.58 77.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 120.691 0.281 . . . . 0.0 111.221 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.526 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.7 mttt -67.53 -33.63 75.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.648 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.1 mt-10 -64.63 -44.41 90.59 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.558 ' HD3' HG23 ' B' ' 63' ' ' ILE . 20.7 ttp180 -56.43 -47.1 79.79 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.68 -41.9 99.34 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.757 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.8 -41.47 78.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.614 0.188 . . . . 0.0 111.243 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.878 HG13 HD11 ' B' ' 26' ' ' LEU . 38.6 t -62.4 -43.53 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 177.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.422 ' HG3' HE22 ' B' ' 53' ' ' GLN . 0.5 OUTLIER -58.06 -52.79 64.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.096 178.061 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -57.16 -53.49 57.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.605 -179.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.802 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.3 tp -63.61 -36.98 85.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.008 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.8 mt -70.42 -45.1 66.56 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 110.43 -0.211 . . . . 0.0 110.43 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.551 ' OE1' ' HB2' ' A' ' 407' ' ' ASP . 12.0 mm100 -62.43 -21.27 65.28 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.007 0.908 . . . . 0.0 109.461 178.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.34 -47.41 9.39 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.194 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.802 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.2 mt -81.44 -46.29 14.79 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -176.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.646 HD23 ' HB3' ' B' ' 47' ' ' TYR . 38.3 mt -52.38 -58.19 12.62 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.619 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 59.2 Cg_exo -54.68 -19.85 19.84 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.325 2.016 . . . . 0.0 113.829 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -84.88 -21.19 29.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 0.0 111.346 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -111.9 -17.76 12.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.659 0.266 . . . . 0.0 111.355 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -63.87 100.5 0.3 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.561 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.452 ' HB3' ' OXT' ' B' ' 108' ' ' ASN . 6.3 mmp_? -128.86 -106.83 0.29 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.63 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp 70.73 -59.3 0.54 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.532 0.733 . . . . 0.0 112.338 178.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.13 20.94 17.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.214 0.53 . . . . 0.0 110.793 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.452 ' OXT' ' HB3' ' B' ' 105' ' ' ARG . 3.1 t-20 . . . . . 0 C--O 1.248 1.012 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.499 ' O ' ' HB ' ' A' ' 393' ' ' VAL . 2.2 p90 . . . . . 0 N--CA 1.482 1.144 0 CA-C-O 120.703 0.287 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . 0.499 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 87.2 t 78.14 121.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.028 0.531 . . . . 0.0 110.029 -179.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 85.32 -59.91 4.79 Favored Glycine 0 CA--C 1.509 -0.314 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -178.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.506 ' OE2' ' HG2' ' B' ' 18' ' ' LYS . 7.5 tp10 -116.57 102.77 9.76 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 176.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -123.83 31.48 5.85 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.461 -177.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.602 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 27.8 t70 -38.4 -36.34 0.23 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.542 ' HG3' ' NZ ' ' B' ' 19' ' ' LYS . 4.5 tt0 177.5 -82.18 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 177.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.88 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 59.5 tt0 -131.25 101.48 5.58 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -178.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.733 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -136.37 89.52 2.48 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 -176.199 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.0 p-10 -139.31 -46.6 0.46 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -72.92 9.37 1.18 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.24 0.543 . . . . 0.0 110.846 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.673 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -50.25 120.26 4.37 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.033 179.812 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.35 131.93 39.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.325 -178.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.485 ' HB3' ' CD ' ' A' ' 408' ' ' GLU . 3.4 mt-10 -97.87 172.6 7.56 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.788 -178.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -162.02 -77.5 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.055 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . 0.76 ' HB2' ' HB3' ' B' ' 52' ' ' CYS . 0.8 OUTLIER -68.25 -57.55 5.81 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.255 0.55 . . . . 0.0 109.832 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.619 ' O ' ' HE3' ' B' ' 51' ' ' LYS . 0.0 OUTLIER 58.91 -115.98 0.82 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.067 179.428 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.509 ' HA ' ' CE ' ' B' ' 51' ' ' LYS . 17.6 t0 -82.7 53.95 2.53 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.565 0.697 . . . . 0.0 110.464 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.247 0.922 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.138 179.091 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.5 mmt . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 120.532 0.206 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.2 -31.62 0.69 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.704 0.288 . . . . 0.0 111.661 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.403 HG22 ' H ' ' B' ' 4' ' ' SER . 0.2 OUTLIER -115.37 175.61 5.44 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.929 -179.374 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.403 ' H ' HG22 ' B' ' 3' ' ' THR . 0.1 OUTLIER -81.66 -51.79 7.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.004 0.43 . . . . 0.0 110.693 179.634 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 9.9 m -96.87 97.25 9.13 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.096 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -124.55 -133.58 0.27 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.287 0.565 . . . . 0.0 110.592 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.431 ' OE1' ' HG ' ' B' ' 9' ' ' LEU . 0.0 OUTLIER -58.87 150.15 24.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.53 179.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 42.9 t -123.77 122.34 64.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 178.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.431 ' HG ' ' OE1' ' B' ' 7' ' ' GLU . 73.9 mt -91.09 -29.34 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.931 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.498 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -139.65 131.32 27.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 78.9 mt -115.05 122.68 69.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.859 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.7 t -114.33 150.34 16.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.647 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.7 mtmp? -114.8 177.22 4.73 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.488 -178.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.579 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.0 OUTLIER 18.71 73.33 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 O-C-N 125.152 1.533 . . . . 0.0 113.343 -178.395 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.724 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.6 t -126.12 129.36 72.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.396 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.68 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 0.3 OUTLIER -99.6 145.19 27.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.053 0.454 . . . . 0.0 111.332 179.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.656 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -132.48 103.22 6.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.169 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.506 ' HG2' ' OE2' ' A' ' 395' ' ' GLU . 35.2 mttp 58.82 54.39 5.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.929 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.602 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 5.0 mptp? 72.19 23.99 3.22 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.898 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.68 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 36.9 mt-30 -126.29 119.63 27.88 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.559 ' HA ' ' HG3' ' B' ' 16' ' ' ARG . 0.8 OUTLIER -85.36 139.18 31.77 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.918 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -174.37 -151.06 8.07 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.753 -0.736 . . . . 0.0 113.589 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.3 140.18 52.38 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 122.73 0.412 . . . . 0.0 110.008 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.943 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -102.03 145.7 28.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.471 -178.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -139.33 112.77 8.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.735 0.303 . . . . 0.0 110.357 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.983 HD11 HG13 ' B' ' 92' ' ' VAL . 12.1 mt -90.27 137.23 32.51 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.13 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.532 ' HB3' ' NH2' ' B' ' 30' ' ' ARG . 42.8 mtt -120.8 167.19 12.77 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.028 -178.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.14 -49.76 8.89 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -122.75 11.59 9.76 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.458 -178.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.578 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.0 OUTLIER -159.6 156.4 27.92 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.253 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 1.024 HD13 HD11 ' B' ' 67' ' ' LEU . 1.5 tt -111.59 122.01 65.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -120.17 150.84 40.0 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.983 0.42 . . . . 0.0 110.775 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.943 ' HB2' HD12 ' B' ' 24' ' ' LEU . 48.2 t90 -146.99 141.2 26.19 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.868 ' HB1' ' HD3' ' B' ' 38' ' ' LYS . . . -139.6 129.46 14.11 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.56 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.918 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 21.1 Cg_endo -62.87 167.42 12.1 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.873 2.382 . . . . 0.0 112.489 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.54 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 72.4 mt-10 -81.65 124.0 29.19 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.479 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 118.36 -30.29 6.07 Favored Glycine 0 C--O 1.228 -0.281 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.766 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.868 ' HD3' ' HB1' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -75.14 171.73 13.64 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.499 0.666 . . . . 0.0 111.762 -179.943 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . 0.519 ' OD1' ' HG3' ' B' ' 40' ' ' ARG . 18.1 p-10 -115.74 -23.07 8.84 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.168 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.519 ' HG3' ' OD1' ' B' ' 39' ' ' ASP . 0.0 OUTLIER -117.72 149.54 40.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.368 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.526 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 50.5 m-85 -70.32 154.61 41.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.576 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.8 p -115.48 -43.3 3.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.258 0.552 . . . . 0.0 109.801 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.656 HG13 ' HG3' ' B' ' 17' ' ' GLN . 18.6 mm -91.44 121.21 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.931 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 23.0 t -147.64 101.39 3.33 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.42 ' CD2' HG23 ' B' ' 43' ' ' ILE . 77.5 m-70 -125.94 138.78 53.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.919 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' B' ' 30' ' ' ARG . 78.8 mmm -88.85 143.75 26.68 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.569 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.9 m-30 -58.12 -20.73 42.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.304 0.573 . . . . 0.0 109.802 178.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . 0.502 ' HA ' ' O ' ' B' ' 103' ' ' PHE . . . -72.81 -18.52 61.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.81 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.63 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.79 -6.36 21.53 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 123.46 0.475 . . . . 0.0 110.232 -179.731 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.59 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.6 mm -90.37 130.58 39.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.619 ' HE3' ' O ' ' A' ' 408' ' ' GLU . 31.8 tttp -91.06 -44.41 9.32 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.488 0.661 . . . . 0.0 110.427 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.76 ' HB3' ' HB2' ' A' ' 407' ' ' ASP . 1.2 p -158.25 -177.31 6.46 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.497 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' B' ' 96' ' ' LEU . 5.0 pt20 -145.3 148.77 33.8 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.793 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.087 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 42.2 mttm -117.03 154.11 31.5 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 176.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.696 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -130.22 128.72 64.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.801 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.6 p -88.81 119.8 69.99 Favored Pre-proline 0 C--O 1.249 1.042 0 C-N-CA 119.93 -0.708 . . . . 0.0 109.155 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.76 173.54 13.79 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 125.255 3.97 . . . . 0.0 114.275 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -59.45 160.93 6.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.127 178.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.18 -29.25 7.79 Favored Glycine 0 C--N 1.317 -0.477 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -177.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.88 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.5 mttp -89.51 153.14 21.03 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.29 -3.36 16.86 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.249 0.547 . . . . 0.0 110.64 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.81 154.26 45.09 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.288 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.628 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -99.85 135.23 36.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.417 ' HB2' HE21 ' B' ' 64' ' ' GLN . 6.1 mt-30 -137.79 162.95 32.58 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.844 -1.142 . . . . 0.0 113.991 -177.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.644 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.4 tp -139.92 153.66 47.01 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.898 -1.501 . . . . 0.0 107.276 177.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.087 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -143.87 141.3 30.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.938 0.79 . . . . 0.0 111.278 178.742 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 1.024 HD11 HD13 ' B' ' 31' ' ' ILE . 64.7 mt -97.77 103.78 15.75 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.145 178.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.669 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.8 t -87.16 105.91 15.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.562 HD22 HD13 ' B' ' 50' ' ' ILE . 3.4 mt -91.18 158.1 16.81 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.012 -177.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.63 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.15 -1.68 45.47 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.162 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.76 -10.69 59.67 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.475 -1.238 . . . . 0.0 110.314 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.84 12.86 48.75 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.058 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -126.33 158.14 36.61 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.964 0.412 . . . . 0.0 110.929 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.669 HG22 ' HA ' ' B' ' 68' ' ' VAL . 15.9 p -128.59 131.6 48.17 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.6 m -104.37 105.34 15.44 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.359 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.733 HD21 ' HB3' ' A' ' 400' ' ' ASP . 5.0 m-20 -82.29 136.97 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.363 0.602 . . . . 0.0 111.956 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.422 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.1 m-85 -121.63 110.85 16.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.13 -0.941 . . . . 0.0 108.598 178.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.724 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.8 t60 -86.53 99.1 11.44 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.658 -1.155 . . . . 0.0 111.804 -177.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.644 ' HE1' ' HB2' ' B' ' 65' ' ' LEU . 71.6 m-85 -77.26 94.24 4.11 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 178.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.18 1.54 39.17 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.579 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -79.99 91.38 5.44 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.86 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.82 -39.68 2.59 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.6 -59.62 4.36 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.523 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.4 p -127.81 9.0 6.35 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -176.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.526 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.23 -50.71 6.4 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.4 -51.91 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.82 0.343 . . . . 0.0 110.811 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.523 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.3 mttt -66.6 -35.17 79.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.874 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.653 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -63.35 -46.54 86.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.636 ' HD2' HD12 ' B' ' 55' ' ' ILE . 22.2 ttp180 -55.73 -48.47 75.14 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . 0.536 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -61.56 -44.66 96.62 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.052 -1.431 . . . . 0.0 112.502 -179.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -43.19 76.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 117.89 0.314 . . . . 0.0 111.097 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.983 HG13 HD11 ' B' ' 26' ' ' LEU . 58.0 t -60.8 -43.57 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.696 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.2 tmmt? -60.37 -55.9 27.95 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.813 178.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -53.32 -55.39 25.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.891 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.766 ' HG ' HD12 ' B' ' 99' ' ' LEU . 14.0 tp -60.96 -41.25 95.99 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.96 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.509 HD12 HG12 ' B' ' 92' ' ' VAL . 27.1 mt -69.36 -42.79 74.77 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.392 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -66.0 -18.51 65.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.903 0.859 . . . . 0.0 109.368 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -86.02 -51.01 6.62 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.759 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.766 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -77.48 -48.15 17.83 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.451 -1.704 . . . . 0.0 115.019 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.59 HD22 ' HB ' ' B' ' 50' ' ' ILE . 19.0 mt -48.92 -56.29 16.07 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.664 ' HA ' ' HG2' ' B' ' 104' ' ' LYS . 19.6 Cg_endo -57.05 -15.33 17.21 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.27 1.98 . . . . 0.0 114.034 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.2 mttm -87.59 -20.51 26.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.502 ' O ' ' HA ' ' B' ' 48' ' ' ALA . 26.7 m-85 -125.8 -19.54 4.86 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.664 ' HG2' ' HA ' ' B' ' 101' ' ' PRO . 16.4 ptpt -53.86 149.45 8.81 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.4 118.21 36.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.071 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.46 ' HD3' ' H ' ' B' ' 107' ' ' ALA . 0.0 OUTLIER -156.52 -46.4 0.07 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.311 178.761 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . 0.46 ' H ' ' HD3' ' B' ' 106' ' ' LYS . . . -154.62 34.51 0.41 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-N 114.528 -1.214 . . . . 0.0 108.49 -178.388 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.735 ' CE2' ' HB3' ' A' ' 395' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 7.7 p -77.61 128.4 38.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 91.31 -63.71 2.69 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.314 -179.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.735 ' HB3' ' CE2' ' A' ' 392' ' ' TYR . 4.7 tp10 -97.29 139.2 33.61 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.486 ' C ' ' H ' ' A' ' 398' ' ' GLU . 25.0 t70 -126.82 32.84 5.05 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.53 16.88 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.934 -1.104 . . . . 0.0 113.76 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.486 ' H ' ' C ' ' A' ' 396' ' ' ASP . 2.5 pt-20 89.2 -37.73 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.334 1.454 . . . . 0.0 113.616 176.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.594 ' HB2' ' HZ1' ' B' ' 62' ' ' LYS . 7.2 tt0 -150.05 122.61 8.54 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.898 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.6 OUTLIER -170.63 83.97 0.1 Allowed 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.929 -177.625 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.458 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.7 p-10 -138.52 -46.4 0.5 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . 0.491 ' OD2' ' HG3' ' B' ' 60' ' ' LYS . 2.6 p30 -72.8 7.25 2.06 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.498 0.666 . . . . 0.0 110.208 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 1.009 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -54.1 126.51 23.01 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.794 179.467 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -111.15 122.15 47.14 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.98 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 8.0 pt-20 -125.61 131.17 52.74 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -178.94 28.34 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.027 0.441 . . . . 0.0 110.662 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.85 -25.79 61.23 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.511 ' OE2' ' HE2' ' B' ' 104' ' ' LYS . 3.5 pt-20 -179.67 -172.09 0.2 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.852 178.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -151.09 89.9 1.56 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.519 ' OD2' ' HB3' ' B' ' 106' ' ' LYS . 17.7 t70 . . . . . 0 C--O 1.243 0.747 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.16 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.602 ' HA ' ' HG2' ' B' ' 6' ' ' GLU . 13.2 tpt . . . . . 0 N--CA 1.484 1.229 0 CA-C-O 120.624 0.249 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.17 -68.24 0.17 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.154 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 24.2 m -155.35 -46.65 0.08 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 3.2 p -160.85 -62.05 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.942 0.401 . . . . 0.0 110.099 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 2.5 m -84.05 81.01 8.98 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.602 ' HG2' ' HA ' ' B' ' 1' ' ' MET . 0.5 OUTLIER -84.61 -169.42 2.62 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.627 -177.207 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.415 ' O ' ' HA ' ' B' ' 27' ' ' MET . 3.0 mp0 -59.22 101.86 0.11 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.686 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 79.7 t -82.8 105.34 12.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.4 mt -84.44 -29.54 26.01 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.728 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.492 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.0 tp -133.32 125.56 29.48 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.9 mt -112.68 116.07 51.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.773 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.5 t -107.05 147.77 11.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.575 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -107.84 175.38 5.5 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.051 -178.54 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.657 ' HE2' ' HA ' ' B' ' 81' ' ' ASN . 29.3 mtpt 18.23 76.17 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 O-C-N 125.147 1.53 . . . . 0.0 113.552 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.575 HG23 ' O ' ' B' ' 13' ' ' LYS . 40.1 t -124.2 120.14 58.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.811 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.579 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 26.3 mtp180 -90.85 125.9 35.88 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.223 0.535 . . . . 0.0 111.032 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.429 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 2.8 tp-100 -117.21 112.18 20.47 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.891 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.1 OUTLIER 66.12 43.18 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.601 0.563 . . . . 0.0 110.639 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 70.59 19.28 6.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.472 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.499 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tt0 -125.93 119.22 27.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.452 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.433 ' CG ' ' HG2' ' B' ' 16' ' ' ARG . 2.2 m-20 -68.68 153.74 43.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.037 0.446 . . . . 0.0 111.689 -179.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 178.43 -158.88 23.83 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.038 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 134.59 49.99 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.218 0.532 . . . . 0.0 110.62 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.938 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.33 139.73 32.85 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.509 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -135.94 108.52 7.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.584 0.23 . . . . 0.0 110.417 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.929 HD11 HG13 ' B' ' 92' ' ' VAL . 9.3 mt -86.84 125.65 34.12 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.628 ' HB2' ' HD2' ' B' ' 30' ' ' ARG . 5.4 mtm -106.69 173.67 6.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.921 0.391 . . . . 0.0 111.57 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.42 -52.9 7.39 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -118.22 8.03 12.23 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.628 ' HD2' ' HB2' ' B' ' 27' ' ' MET . 0.0 OUTLIER -158.7 151.0 21.55 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.95 -1.1 . . . . 0.0 112.666 -178.249 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.961 HD13 HD11 ' B' ' 67' ' ' LEU . 0.9 OUTLIER -97.69 122.77 49.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.576 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -124.78 156.64 37.4 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.993 0.425 . . . . 0.0 110.828 -179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.938 ' HB2' HD12 ' B' ' 24' ' ' LEU . 39.1 t90 -147.12 132.72 18.78 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.453 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -114.7 136.25 22.44 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.105 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.871 ' HB2' ' HD2' ' B' ' 38' ' ' LYS . 24.0 Cg_exo -61.57 159.06 33.75 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.19 1.927 . . . . 0.0 111.062 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -62.47 134.54 56.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.308 0.575 . . . . 0.0 111.682 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 62.62 12.35 40.24 Favored Glycine 0 CA--C 1.521 0.414 0 CA-C-N 115.552 -0.749 . . . . 0.0 113.993 179.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.871 ' HD2' ' HB2' ' B' ' 35' ' ' PRO . 40.4 mttp -113.43 140.77 47.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.384 0.592 . . . . 0.0 110.807 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -85.18 -14.12 47.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.141 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.439 ' HG2' ' H ' ' B' ' 40' ' ' ARG . 2.2 ptp180 -106.13 129.9 54.12 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.188 0.518 . . . . 0.0 112.322 -178.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.442 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 45.3 m-85 -78.19 121.14 23.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.26 178.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 7.5 p -94.62 -7.72 40.1 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.642 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -119.95 118.65 57.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.306 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.2 t -148.01 101.61 3.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.823 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -124.13 137.22 54.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.465 ' O ' HG12 ' B' ' 50' ' ' ILE . 33.0 mtp -88.94 142.32 27.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.638 ' HB3' ' HA ' ' B' ' 100' ' ' LEU . 20.4 m-85 -57.5 -23.0 47.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.696 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.26 -27.21 65.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.938 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.564 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.15 -5.84 43.14 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.873 0.368 . . . . 0.0 111.147 -179.025 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.766 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -89.36 129.86 39.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.608 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 1.1 tttp -90.06 -41.39 11.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.201 0.524 . . . . 0.0 110.641 -178.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.608 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 4.7 p -163.79 -177.6 5.23 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.76 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . 0.664 ' OE1' ' HA ' ' B' ' 93' ' ' LYS . 5.5 pt20 -140.58 145.49 36.8 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.371 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.063 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 53.6 mttp -108.39 136.7 47.59 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.491 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -118.78 124.63 73.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 176.056 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.41 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -85.04 118.35 70.7 Favored Pre-proline 0 C--O 1.25 1.102 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -178.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 68.8 Cg_endo -68.88 173.24 10.46 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 125.117 3.878 . . . . 0.0 113.996 -178.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 160.5 5.67 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.482 -1.235 . . . . 0.0 109.885 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.13 7.91 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.491 ' HG3' ' OD2' ' A' ' 402' ' ' ASP . 5.6 mttp -86.82 153.79 21.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.57 -14.14 62.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.436 0.636 . . . . 0.0 109.944 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.594 ' HZ1' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -137.69 141.79 41.08 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.557 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.508 HG21 ' HA ' ' B' ' 86' ' ' VAL . 3.8 mp -84.27 133.81 28.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -134.57 162.89 31.03 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 118.559 -1.256 . . . . 0.0 114.359 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.488 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.82 152.96 46.94 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 113.791 -1.55 . . . . 0.0 107.909 177.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.063 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.72 145.58 30.03 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.629 0.649 . . . . 0.0 110.48 177.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.961 HD11 HD13 ' B' ' 31' ' ' ILE . 96.1 mt -96.94 111.7 23.79 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.052 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.556 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.1 t -95.54 112.86 28.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.618 HD22 HD13 ' B' ' 50' ' ' ILE . 1.7 mt -97.43 158.46 15.46 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.564 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -80.21 -1.77 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.29 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.403 ' HB3' ' OD1' ' B' ' 73' ' ' ASP . . . -73.46 -16.68 61.3 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.67 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 103.02 8.66 41.4 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.899 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.507 ' OD1' HD12 ' B' ' 69' ' ' LEU . 8.0 p-10 -126.42 172.24 10.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.199 0.523 . . . . 0.0 111.841 -179.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.556 HG22 ' HA ' ' B' ' 68' ' ' VAL . 30.4 p -137.58 143.57 41.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.574 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.554 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 16.7 m -116.82 109.38 17.02 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.504 0.322 . . . . 0.0 110.511 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.898 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.9 m-20 -82.31 154.46 25.3 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.38 0.61 . . . . 0.0 112.628 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.642 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.7 m-85 -141.5 104.01 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.834 -1.075 . . . . 0.0 108.834 178.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.579 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.2 t-160 -86.9 105.28 16.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.493 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.62 ' CE1' HG11 ' B' ' 12' ' ' VAL . 48.9 m-85 -76.71 101.61 5.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.3 p -95.62 7.27 46.75 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.949 0.404 . . . . 0.0 111.69 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.657 ' HA ' ' HE2' ' B' ' 14' ' ' LYS . 63.8 t30 -86.09 90.81 8.23 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -33.66 18.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 41.1 m -58.89 -59.96 4.62 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.486 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 21.5 p -127.78 13.15 6.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.513 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -46.52 -45.01 18.27 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.508 ' HA ' HG21 ' B' ' 63' ' ' ILE . 2.9 t -59.57 -54.72 30.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.006 0.432 . . . . 0.0 110.563 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.486 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 2.7 mptt -65.56 -36.76 84.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.192 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.686 ' O ' HG23 ' B' ' 92' ' ' VAL . 14.0 mt-10 -65.04 -43.56 91.97 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.498 ' HD3' HG23 ' B' ' 63' ' ' ILE . 23.9 ttp180 -56.6 -49.26 75.45 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.51 -42.75 97.06 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.368 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -44.1 78.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.822 0.283 . . . . 0.0 110.97 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.929 HG13 HD11 ' B' ' 26' ' ' LEU . 38.9 t -60.26 -43.63 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.664 ' HA ' ' OE1' ' B' ' 53' ' ' GLN . 2.9 ttpt -60.19 -53.42 57.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.138 178.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 2.1 m-20 -56.3 -51.25 68.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.879 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.722 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.7 tp -64.89 -37.39 87.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.719 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.413 HD12 HG12 ' B' ' 92' ' ' VAL . 27.9 mt -72.31 -47.59 48.72 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 121.308 -0.157 . . . . 0.0 111.06 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.515 ' N ' HE22 ' B' ' 53' ' ' GLN . 13.5 pt20 -60.01 -21.66 61.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.193 0.997 . . . . 0.0 109.143 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.421 ' O ' ' HG3' ' B' ' 102' ' ' LYS . 1.4 mm-40 -85.94 -47.83 9.26 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.135 -1.393 . . . . 0.0 111.363 178.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.722 HD12 ' HG ' ' B' ' 95' ' ' LEU . 13.6 mt -81.84 -38.69 25.09 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.766 HD22 ' HB ' ' B' ' 50' ' ' ILE . 30.2 mt -53.14 -62.66 3.18 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.602 ' HA ' ' HE3' ' B' ' 104' ' ' LYS . 40.3 Cg_endo -66.51 -7.7 18.64 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.815 1.677 . . . . 0.0 113.36 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' B' ' 98' ' ' GLN . 12.4 mtmm -81.26 -31.87 33.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.784 0.326 . . . . 0.0 110.309 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -104.87 -35.4 7.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.196 0.522 . . . . 0.0 110.614 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.602 ' HE3' ' HA ' ' B' ' 101' ' ' PRO . 0.8 OUTLIER -77.34 110.72 12.31 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.002 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -124.81 60.71 1.18 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.166 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.519 ' HB3' ' OD2' ' A' ' 410' ' ' ASP . 2.4 ttpm? -95.73 -61.31 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.546 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -144.21 15.57 1.68 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.434 -0.506 . . . . 0.0 112.199 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.423 ' HB3' ' NZ ' ' B' ' 104' ' ' LYS . 55.6 t30 . . . . . 0 C--O 1.249 1.065 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.587 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.557 ' CG ' ' HB2' ' A' ' 396' ' ' ASP . 0.3 OUTLIER . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.523 0.202 . . . . 0.0 110.526 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.15 -107.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -73.84 -18.05 79.47 Favored Glycine 0 C--O 1.227 -0.311 0 N-CA-C 108.34 -1.904 . . . . 0.0 108.34 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.463 ' HG3' ' H ' ' A' ' 397' ' ' ASP . 7.2 tp10 -172.15 157.75 4.36 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 112.609 -1.795 . . . . 0.0 106.192 178.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.557 ' HB2' ' CG ' ' A' ' 392' ' ' TYR . 17.1 t70 -105.81 30.44 5.8 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.579 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.588 ' HA ' ' HA ' ' B' ' 18' ' ' LYS . 14.6 t70 -53.78 -34.93 60.62 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.427 ' HB3' ' CD ' ' B' ' 62' ' ' LYS . 0.1 OUTLIER 166.49 -30.04 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 O-C-N 124.332 1.02 . . . . 0.0 110.396 177.666 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.89 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 65.1 tt0 173.01 95.08 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -178.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.612 ' HB3' ' CE1' ' A' ' 403' ' ' PHE . 2.4 m-20 -140.87 92.05 2.47 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.451 -175.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.521 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.4 OUTLIER -139.51 -48.39 0.47 Allowed 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -73.13 17.5 0.13 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.636 0.731 . . . . 0.0 111.229 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.921 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -55.64 128.74 36.09 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.878 179.124 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -101.9 133.33 46.85 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.4 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.45 ' HB2' ' HG2' ' B' ' 54' ' ' LYS . 10.0 tt0 -121.8 139.98 52.93 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.214 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.23 42.44 0.13 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . 0.595 ' HB3' ' HB2' ' B' ' 52' ' ' CYS . 1.3 t70 -109.61 -7.28 15.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.882 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.451 ' HB3' ' H ' ' A' ' 409' ' ' ASP . 0.4 OUTLIER 52.98 -159.29 0.13 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.954 -1.021 . . . . 0.0 113.032 179.457 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.451 ' H ' ' HB3' ' A' ' 408' ' ' GLU . 1.3 m-20 -111.94 8.83 20.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.046 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.411 ' C ' ' HD2' ' B' ' 104' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.905 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.377 -179.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.547 ' H2 ' ' CD ' ' B' ' 6' ' ' GLU . 1.9 mpt? . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.71 37.17 19.19 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.501 0.667 . . . . 0.0 109.762 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 4.5 m -77.83 -63.28 1.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.609 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.58 ' HB2' ' HG2' ' B' ' 29' ' ' GLU . 20.0 m -148.41 -57.71 0.23 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 121.199 -0.2 . . . . 0.0 110.824 179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 2.7 p -129.45 -28.52 2.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.547 ' CD ' ' H2 ' ' B' ' 1' ' ' MET . 5.2 tp10 66.45 21.45 10.83 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.859 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.454 ' O ' ' HA ' ' B' ' 27' ' ' MET . 15.2 pt-20 -81.56 115.65 20.96 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.041 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 70.2 t -84.13 112.6 21.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.682 ' HB2' HD21 ' B' ' 95' ' ' LEU . 23.0 mt -87.04 -28.9 22.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.158 -178.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.447 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -140.1 138.24 35.13 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 86.1 mt -121.75 126.47 74.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.699 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.0 t -118.25 148.24 21.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.638 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -110.62 -178.68 3.55 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.349 -179.358 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.494 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 47.8 mtpt 18.06 69.39 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.697 0 O-C-N 125.42 1.7 . . . . 0.0 113.559 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.638 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.5 t -119.17 123.35 71.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.558 179.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.639 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 13.8 mtp-105 -98.14 121.36 39.97 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.086 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.446 HE21 ' HB3' ' B' ' 17' ' ' GLN . 0.7 OUTLIER -105.63 103.29 12.77 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.157 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 50.9 mttt 52.81 62.87 2.47 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.761 0.663 . . . . 0.0 110.937 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 396' ' ' ASP . 1.9 mptm? 68.43 24.61 7.13 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.069 -0.969 . . . . 0.0 113.088 178.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.639 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 20.5 mt-30 -129.84 119.31 23.13 Favored 'General case' 0 C--O 1.222 -0.375 0 O-C-N 122.23 -0.293 . . . . 0.0 111.275 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -75.08 145.04 42.64 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.149 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.33 -167.64 39.34 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.653 -0.784 . . . . 0.0 113.613 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.86 137.68 54.69 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.125 0.57 . . . . 0.0 109.803 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.928 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -100.54 140.82 34.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.232 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -135.62 124.67 24.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.844 HD11 HG13 ' B' ' 92' ' ' VAL . 16.0 mt -108.03 122.85 47.7 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.668 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.454 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 1.4 mpt? -103.35 160.88 14.31 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.49 -22.24 54.36 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.58 ' HG2' ' HB2' ' B' ' 4' ' ' SER . 1.1 mp0 -105.96 -23.23 12.71 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' B' ' 45' ' ' HIS . 0.0 OUTLIER -160.38 172.72 16.78 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.692 -0.803 . . . . 0.0 112.879 -176.582 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.983 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -112.67 122.89 67.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.742 178.3 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.473 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -122.57 150.45 42.59 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.928 ' HB2' HD12 ' B' ' 24' ' ' LEU . 36.8 t90 -146.87 137.02 23.49 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -123.86 142.32 39.15 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.5 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.1 159.08 48.45 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.379 2.053 . . . . 0.0 111.167 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.12 137.37 57.98 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.379 -179.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.8 29.81 75.84 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.333 -0.849 . . . . 0.0 113.192 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.444 ' HA ' ' HD3' ' B' ' 38' ' ' LYS . 19.1 mmtm -113.7 151.82 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.057 0.429 . . . . 0.0 110.936 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -99.82 -12.76 19.62 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.866 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -123.49 146.41 48.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.059 0.457 . . . . 0.0 111.571 -178.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -87.06 121.64 29.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.002 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.4 p -85.84 -23.65 27.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.34 0.59 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.6 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 16.4 mm -103.42 118.74 50.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.018 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 33.4 t -147.83 101.45 3.31 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.502 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 68.9 m-70 -124.67 132.03 53.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.221 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.536 ' O ' HG12 ' B' ' 50' ' ' ILE . 81.1 mmm -81.85 143.32 31.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.468 ' CE1' HD13 ' B' ' 99' ' ' LEU . 22.3 m-30 -56.97 -24.08 50.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 110.608 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.22 -27.55 64.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.992 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.575 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -93.35 -7.16 45.57 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.021 0.438 . . . . 0.0 110.683 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.625 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.0 mm -87.88 130.64 37.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.863 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 1.5 ttpt -87.52 -37.58 16.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.298 0.571 . . . . 0.0 109.817 -179.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.863 ' SG ' ' HE2' ' B' ' 51' ' ' LYS . 21.8 p -171.89 -178.13 2.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.78 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -143.33 140.77 30.7 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.262 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.062 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.8 mttp -107.04 156.17 19.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.527 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.6 OUTLIER -131.56 131.57 62.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 176.227 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -93.11 120.77 66.66 Favored Pre-proline 0 C--O 1.252 1.209 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.59 172.75 12.85 Favored 'Trans proline' 0 C--O 1.233 0.246 1 C-N-CA 125.319 4.013 . . . . 0.0 114.57 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -64.04 160.48 17.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.158 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.72 -29.03 8.08 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -178.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.89 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.6 mttp -86.96 160.36 18.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.9 -9.86 59.63 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.401 0.62 . . . . 0.0 109.658 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.638 ' HD3' ' HB3' ' A' ' 399' ' ' GLU . 3.7 ptmt -134.5 129.82 35.73 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.194 -179.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.48 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -83.53 131.53 33.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 177.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.588 ' CG ' ' HE2' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -137.95 163.88 30.42 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -175.366 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.526 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.5 tp -139.63 153.46 47.33 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.046 -1.888 . . . . 0.0 106.842 176.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.062 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.3 138.02 24.81 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 119.254 0.934 . . . . 0.0 111.451 179.085 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.983 HD11 HD13 ' B' ' 31' ' ' ILE . 95.8 mt -94.01 100.54 12.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.923 179.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.703 ' HA ' HG22 ' B' ' 74' ' ' THR . 5.2 t -84.14 104.34 12.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.057 -0.719 . . . . 0.0 109.057 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.613 HD22 HD13 ' B' ' 50' ' ' ILE . 2.9 mt -91.36 158.67 16.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.913 0.387 . . . . 0.0 111.408 -178.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.575 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -81.25 -0.6 41.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.163 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.77 -9.29 58.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.582 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.08 9.7 56.85 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.0 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -126.4 151.58 47.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.927 0.394 . . . . 0.0 110.861 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.703 HG22 ' HA ' ' B' ' 68' ' ' VAL . 21.8 p -121.4 130.34 53.54 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.561 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 2.5 m -99.02 98.65 9.67 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.439 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.6 m-20 -83.9 143.39 29.9 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.102 0.477 . . . . 0.0 111.28 -178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.454 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 65.2 m-85 -128.85 112.8 14.51 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.131 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.565 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 6.2 t-160 -86.55 104.75 16.29 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.639 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.697 ' CE2' HG11 ' B' ' 12' ' ' VAL . 52.2 m-85 -76.45 94.32 3.65 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 5.8 p -99.28 12.82 35.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.494 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 40.3 t30 -85.09 91.94 8.24 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -45.93 -32.38 2.68 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 123.836 0.854 . . . . 0.0 112.928 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.26 -60.64 2.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.508 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -128.63 11.88 6.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 -176.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.659 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -42.94 -50.31 5.83 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.41 -52.32 60.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.868 0.366 . . . . 0.0 110.91 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.508 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.45 -35.68 80.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.9 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.682 ' O ' HG23 ' B' ' 92' ' ' VAL . 14.3 mt-10 -64.75 -44.31 90.52 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.502 ' HD2' HD12 ' B' ' 55' ' ' ILE . 20.6 ttp180 -56.18 -48.64 75.97 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.6 -43.83 96.99 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.588 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.4 -42.23 83.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 117.713 0.233 . . . . 0.0 111.178 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.844 HG13 HD11 ' B' ' 26' ' ' LEU . 38.2 t -62.23 -43.85 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.434 ' HB2' HD11 ' B' ' 65' ' ' LEU . 0.6 OUTLIER -57.9 -53.98 52.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.992 178.118 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.7 -54.54 45.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.868 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.863 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.7 tp -62.08 -35.7 79.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.355 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.45 HD12 HG12 ' B' ' 92' ' ' VAL . 28.3 mt -74.41 -47.37 34.24 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' B' ' 97' ' ' GLN . 0.0 OUTLIER -60.29 -21.59 62.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.278 1.037 . . . . 0.0 109.136 178.682 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -87.03 -45.49 10.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.171 -1.377 . . . . 0.0 111.482 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.863 HD12 ' HG ' ' B' ' 95' ' ' LEU . 10.6 mt -85.0 -43.81 13.64 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -176.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.625 HD22 ' HB ' ' B' ' 50' ' ' ILE . 22.7 mt -51.21 -60.51 5.56 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -176.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.494 ' O ' ' HA ' ' B' ' 107' ' ' ALA . 26.1 Cg_endo -59.72 -5.76 3.83 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.496 2.131 . . . . 0.0 114.177 -177.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -85.65 -20.89 28.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.852 0.358 . . . . 0.0 110.486 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -126.52 -15.41 5.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.455 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.469 ' HB3' ' HA ' ' B' ' 101' ' ' PRO . 26.8 ttmt -66.01 124.15 21.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.113 -178.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 64.82 -74.05 0.05 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.264 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' B' ' 106' ' ' LYS . 1.2 ttpm? -163.33 12.78 0.06 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 -178.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' B' ' 101' ' ' PRO . . . 59.44 78.27 0.27 Allowed 'General case' 0 C--O 1.234 0.237 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -177.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 . . . . . 0 C--O 1.244 0.78 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.173 -178.107 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 33.6 p90 . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 17.4 t -62.63 105.28 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 111.98 -91.6 0.61 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.079 -1.208 . . . . 0.0 110.079 -178.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.54 ' OE2' ' HA ' ' A' ' 395' ' ' GLU . 3.2 tp10 -94.22 135.94 35.05 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 398' ' ' GLU . 1.6 t70 -122.15 30.7 6.47 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -179.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.98 15.67 0.19 Allowed 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.361 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.504 ' H ' ' C ' ' A' ' 396' ' ' ASP . 15.2 tt0 94.78 -84.45 0.0 OUTLIER 'General case' 0 C--N 1.343 0.313 0 C-N-CA 125.293 1.437 . . . . 0.0 114.331 176.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.952 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.1 tt0 -126.0 96.83 4.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.738 0.304 . . . . 0.0 111.548 -176.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.516 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 6.9 p-10 -136.53 91.67 2.68 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.511 0.672 . . . . 0.0 111.725 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.495 ' C ' ' H ' ' A' ' 403' ' ' PHE . 26.3 p-10 -139.16 -47.4 0.48 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -71.92 9.33 0.95 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.515 0.674 . . . . 0.0 110.592 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.798 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -52.03 118.3 3.37 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' B' ' 54' ' ' LYS . 1.0 OUTLIER -79.43 130.42 35.4 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.509 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.652 ' HG2' ' HE3' ' B' ' 54' ' ' LYS . 1.9 mm-40 -90.15 176.67 6.68 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.494 0.664 . . . . 0.0 112.044 -178.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -155.16 146.18 22.61 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.225 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -113.22 14.89 19.46 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.595 ' HG2' ' HB2' ' B' ' 97' ' ' GLN . 0.0 OUTLIER -71.98 51.35 0.22 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.822 0.344 . . . . 0.0 111.921 -179.739 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.59 -64.3 0.91 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.511 ' HB3' ' HD2' ' B' ' 104' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.143 0 O-C-N 124.792 1.307 . . . . 0.0 109.042 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 54.1 ttm . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.42 -28.69 1.27 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.211 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 56.9 p -100.68 -165.07 1.17 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.333 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -87.92 33.1 0.72 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.374 0.606 . . . . 0.0 110.153 179.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . 0.42 ' O ' ' HB2' ' B' ' 6' ' ' GLU . 66.1 m -155.13 -152.64 0.41 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.706 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' B' ' 5' ' ' SER . 24.3 mt-10 78.7 24.15 0.59 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.573 0.701 . . . . 0.0 109.725 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -93.72 101.19 13.32 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.658 179.514 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.523 HG11 HG12 ' B' ' 11' ' ' ILE . 74.3 t -92.7 112.75 26.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 CA-C-O 120.905 0.383 . . . . 0.0 110.493 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.6 mt -88.86 -32.17 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.433 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.536 ' HB3' ' HB2' ' B' ' 26' ' ' LEU . 6.1 tp -129.87 123.52 31.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.59 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.523 HG12 HG11 ' B' ' 8' ' ' VAL . 56.5 mt -107.97 120.9 60.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.878 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.2 t -112.13 149.99 14.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.617 ' O ' HG23 ' B' ' 15' ' ' VAL . 2.0 mtmp? -115.9 -179.78 3.75 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.705 -178.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 18.15 63.51 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 O-C-N 125.214 1.571 . . . . 0.0 113.937 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.3 t -113.73 127.09 71.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 84.0 mtt180 -100.6 126.63 47.1 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 121.409 0.623 . . . . 0.0 111.619 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.497 ' HB3' ' CH2' ' B' ' 33' ' ' TRP . 5.6 tp-100 -105.84 103.39 12.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 0.6 OUTLIER 63.89 47.22 3.58 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.658 0.599 . . . . 0.0 110.16 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' B' ' 18' ' ' LYS . 0.4 OUTLIER 74.08 9.22 4.65 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.138 179.364 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.673 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 4.4 tp-100 -104.89 118.44 36.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.45 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 0.4 OUTLIER -72.11 147.5 46.63 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.328 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.578 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . 178.29 -160.68 26.96 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.904 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.4 136.21 50.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.965 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.32 139.11 33.76 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.298 -179.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . 0.404 ' CE1' HG23 ' B' ' 11' ' ' ILE . 75.7 m-85 -132.63 109.59 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.389 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 1.049 HD11 HG13 ' B' ' 92' ' ' VAL . 9.0 mt -87.46 125.22 34.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.836 0.35 . . . . 0.0 110.892 -179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.538 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 41.6 mtt -103.73 164.02 11.95 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.98 -39.18 71.45 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.944 ' HA ' ' HZ ' ' B' ' 103' ' ' PHE . 25.9 mm-40 -113.02 1.49 15.38 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.455 ' NH1' ' HB2' ' B' ' 29' ' ' GLU . 0.0 OUTLIER -161.76 154.61 20.43 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 119.522 -0.871 . . . . 0.0 112.76 -178.064 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.815 HD13 HD11 ' B' ' 67' ' ' LEU . 1.2 tt -102.81 118.13 49.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -118.56 152.2 36.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.398 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.965 ' HB2' HD12 ' B' ' 24' ' ' LEU . 38.1 t90 -147.09 134.71 21.01 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.451 ' HB2' ' CD2' ' B' ' 41' ' ' PHE . . . -120.96 129.61 25.22 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.78 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.641 ' HG2' ' HD3' ' B' ' 38' ' ' LYS . 47.4 Cg_endo -73.55 143.71 34.77 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.498 2.132 . . . . 0.0 111.7 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.557 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 63.2 mt-10 -61.64 131.2 49.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 0.0 110.856 -179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.65 -10.62 60.96 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.834 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.641 ' HD3' ' HG2' ' B' ' 35' ' ' PRO . 5.8 mptt -113.65 152.51 30.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -100.9 -18.5 16.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.68 127.91 53.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.008 0.432 . . . . 0.0 111.816 -178.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.451 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 44.6 m-85 -63.95 121.09 13.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.56 178.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.38 -34.23 23.62 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.984 0.421 . . . . 0.0 110.843 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.829 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 24.2 mm -93.43 122.69 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.909 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 35.8 t -147.95 101.2 3.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.403 ' CD2' HG23 ' B' ' 43' ' ' ILE . 79.9 m-70 -127.43 140.51 52.12 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.491 ' O ' HG12 ' B' ' 50' ' ' ILE . 27.8 mtp -91.82 144.88 25.04 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.746 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.5 m-30 -60.29 -19.8 56.49 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.838 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.92 -21.53 63.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.379 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.533 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -101.51 -11.28 19.42 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.001 0.429 . . . . 0.0 110.6 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.751 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.5 mm -88.68 125.89 41.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.642 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 9.3 tmtt? -86.18 -38.04 18.07 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.03 0.443 . . . . 0.0 109.919 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.642 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 28.3 p -169.55 -177.81 2.86 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.402 -0.817 . . . . 0.0 108.917 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.11 141.94 46.12 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.751 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.064 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 26.9 mttp -102.62 146.7 27.79 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.569 ' HB ' ' HD2' ' B' ' 89' ' ' ARG . 0.8 OUTLIER -126.77 126.82 69.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.174 -1.046 . . . . 0.0 108.174 177.247 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.449 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -89.56 118.5 69.09 Favored Pre-proline 0 C--O 1.249 1.062 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.76 173.03 10.65 Favored 'Trans proline' 0 C--O 1.236 0.389 0 C-N-CA 125.079 3.853 . . . . 0.0 114.624 -177.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -61.69 160.51 11.5 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.395 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.69 -29.02 8.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 109.606 -1.397 . . . . 0.0 109.606 -177.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.952 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 12.8 mttp -87.75 152.66 21.95 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.06 -11.11 60.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.212 0.529 . . . . 0.0 110.544 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.487 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.95 138.0 35.21 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.661 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.533 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.5 mp -83.3 140.55 16.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 177.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.449 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 17.4 mt-30 -139.98 162.86 34.19 Favored 'General case' 0 CA--C 1.511 -0.552 0 C-N-CA 118.529 -1.269 . . . . 0.0 114.081 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 2.1 tp -142.38 153.81 44.09 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.58 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.064 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.37 144.83 30.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 118.978 0.808 . . . . 0.0 110.328 178.025 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.815 HD11 HD13 ' B' ' 31' ' ' ILE . 96.7 mt -94.06 104.51 16.54 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.229 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.616 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 45.0 t -88.92 120.36 37.5 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.487 HD12 ' HB3' ' B' ' 73' ' ' ASP . 9.4 mt -101.93 151.78 21.71 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.112 0.482 . . . . 0.0 111.791 -177.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.533 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.2 -7.55 54.15 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.611 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.3 -4.79 46.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.425 -1.262 . . . . 0.0 110.875 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.73 21.53 46.77 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.487 ' HB3' HD12 ' B' ' 69' ' ' LEU . 20.1 t70 -126.02 160.92 28.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.446 -0.377 . . . . 0.0 110.222 -179.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.594 HG22 ' HA ' ' B' ' 68' ' ' VAL . 12.0 p -142.68 131.48 22.79 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.571 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 19.9 m -110.77 107.07 16.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.266 0.226 . . . . 0.0 110.434 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.29 151.18 26.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.517 . . . . 0.0 112.318 -178.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.829 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 35.9 m-85 -134.93 115.53 13.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.606 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.63 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 3.0 t-160 -87.35 100.91 13.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.887 -179.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.703 ' HZ ' HG21 ' B' ' 92' ' ' VAL . 22.9 m-85 -77.12 102.13 6.43 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.76 22.19 15.67 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.862 0.689 . . . . 0.0 112.862 -178.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.437 HD22 ' HA ' ' B' ' 81' ' ' ASN . 1.2 t-20 -89.45 97.06 10.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 110.292 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.09 -30.29 2.68 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.42 -59.53 2.69 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -178.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.482 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.0 p -127.38 11.05 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -175.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.643 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -45.63 -45.67 14.06 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.475 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.3 t -59.88 -52.67 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.803 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.5 mttt -67.52 -34.52 77.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.038 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.666 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.1 mt-10 -65.06 -45.61 84.59 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.569 ' HD2' ' HB ' ' B' ' 55' ' ' ILE . 24.7 ttp180 -54.06 -47.79 71.27 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 122.21 1.005 . . . . 0.0 108.398 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.27 -44.98 93.59 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.514 -1.675 . . . . 0.0 112.6 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.67 90.91 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.74 0.245 . . . . 0.0 111.154 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 1.049 HG13 HD11 ' B' ' 26' ' ' LEU . 42.9 t -60.87 -44.89 98.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -57.93 -54.65 44.51 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.063 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . 0.473 ' O ' ' HG2' ' B' ' 97' ' ' GLN . 1.6 m-20 -55.37 -52.16 64.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.494 -1.23 . . . . 0.0 112.525 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.823 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -65.23 -28.42 69.35 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.822 -178.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 35.5 mt -78.47 -45.74 21.38 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.377 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.595 ' HB2' ' HG2' ' A' ' 408' ' ' GLU . 24.7 pt20 -63.14 -18.24 63.22 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.249 1.023 . . . . 0.0 109.156 178.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -88.47 -47.96 7.96 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.927 -1.488 . . . . 0.0 111.057 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.823 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -83.62 -41.31 17.97 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.751 HD22 ' HB ' ' B' ' 50' ' ' ILE . 35.7 mt -51.96 -50.85 76.01 Favored Pre-proline 0 CA--C 1.54 0.596 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 -176.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.441 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 21.6 Cg_exo -66.08 -23.09 53.82 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.182 1.921 . . . . 0.0 115.146 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 11.0 pttp -72.49 1.81 7.41 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.941 -0.475 . . . . 0.0 112.096 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.944 ' HZ ' ' HA ' ' B' ' 29' ' ' GLU . 30.2 m-85 -106.27 2.51 26.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.384 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.511 ' HD2' ' HB3' ' A' ' 410' ' ' ASP . 33.3 mttt -131.15 -178.39 4.81 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.768 -178.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.8 77.12 0.89 Allowed 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -116.25 -66.64 1.06 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.145 178.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -123.62 18.23 9.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.854 0.359 . . . . 0.0 111.692 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.244 0.779 0 CA-C-O 118.74 -0.648 . . . . 0.0 109.75 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.449 ' HB2' ' H ' ' A' ' 393' ' ' VAL . 1.6 p90 . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 120.623 0.249 . . . . 0.0 110.701 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . 0.449 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 7.6 p -66.3 137.41 24.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.731 0.301 . . . . 0.0 110.286 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 83.7 -65.59 4.08 Favored Glycine 0 N--CA 1.451 -0.317 0 N-CA-C 111.129 -0.789 . . . . 0.0 111.129 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.505 ' OE2' ' HG2' ' B' ' 18' ' ' LYS . 7.4 tp10 -121.8 130.7 53.6 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -136.72 29.93 2.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.468 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.64 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 36.7 t70 -54.04 -41.2 67.81 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.571 -178.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.485 ' HB3' ' H ' ' A' ' 399' ' ' GLU . 0.2 OUTLIER 172.55 -102.02 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 178.35 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.539 ' O ' ' HE3' ' B' ' 60' ' ' LYS . 3.8 pt-20 -105.04 104.34 14.05 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.831 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -132.77 83.91 2.1 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.758 -178.612 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.493 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.7 p-10 -138.23 -47.37 0.52 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -73.81 12.28 0.7 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.513 0.673 . . . . 0.0 110.442 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.826 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -53.78 122.13 9.31 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.884 179.44 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -86.12 135.89 33.43 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.716 ' HB2' ' HG2' ' B' ' 54' ' ' LYS . 33.4 tt0 -144.31 162.49 36.28 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 121.973 0.892 . . . . 0.0 113.373 -177.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . 0.431 ' N ' ' HG2' ' A' ' 405' ' ' GLU . 35.6 t30 -131.48 147.43 52.55 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 105.301 -2.111 . . . . 0.0 105.301 176.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.06 -59.59 5.12 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.941 -0.704 . . . . 0.0 111.347 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 32.56 48.5 0.12 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 124.529 1.143 . . . . 0.0 111.709 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -45.79 -48.26 15.58 Favored 'General case' 0 CA--C 1.514 -0.406 0 O-C-N 123.899 0.749 . . . . 0.0 110.2 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.614 ' HB3' ' HE3' ' B' ' 104' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.169 0 O-C-N 124.847 1.342 . . . . 0.0 112.183 178.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -166.24 -67.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.606 -179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 13.0 m -158.01 88.93 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.366 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 14.7 m 72.65 -56.17 0.66 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.656 0.782 . . . . 0.0 111.619 179.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 4.7 m -76.43 128.28 34.5 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 71.05 22.15 4.62 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.877 0.846 . . . . 0.0 109.939 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.468 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.5 OUTLIER -76.73 114.59 15.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.127 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -81.97 115.94 25.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 22.0 mt -96.0 -30.39 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.092 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.463 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -132.92 122.73 24.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 80.3 mt -109.13 118.36 56.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.74 HG11 ' HE2' ' B' ' 79' ' ' PHE . 2.6 t -112.22 147.79 15.77 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.648 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.0 OUTLIER -109.22 -177.65 3.35 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 18.97 74.29 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 O-C-N 125.388 1.68 . . . . 0.0 112.883 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.648 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.8 t -124.44 122.59 64.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.314 179.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.627 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 7.3 mtp180 -96.25 130.98 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.353 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.613 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 0.7 OUTLIER -121.42 103.38 8.9 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.612 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.505 ' HG2' ' OE2' ' A' ' 395' ' ' GLU . 5.7 mtpp 59.15 64.89 1.29 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.179 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.64 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 1.0 OUTLIER 68.93 22.89 6.9 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 176.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.655 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.9 pt20 -145.69 132.64 20.21 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.995 0.816 . . . . 0.0 110.858 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.41 ' CA ' ' HG2' ' B' ' 16' ' ' ARG . 1.6 t70 -86.23 153.76 21.78 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -177.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.07 -156.34 17.09 Favored Glycine 0 CA--C 1.522 0.516 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.756 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.31 135.11 54.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.882 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -100.69 140.85 34.38 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.481 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -135.96 109.83 8.17 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.817 0.342 . . . . 0.0 110.236 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.956 HD11 HG13 ' B' ' 92' ' ' VAL . 10.6 mt -89.0 120.84 30.78 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.53 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.468 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 36.5 mtt -102.24 161.56 13.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.043 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -28.82 57.86 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.927 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.92 -16.9 13.43 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 4.7 ptp85 -158.91 162.01 36.84 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.796 -0.761 . . . . 0.0 112.822 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.898 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -101.07 114.81 41.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.741 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -113.56 150.36 33.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.976 0.417 . . . . 0.0 110.836 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.882 ' HB2' HD12 ' B' ' 24' ' ' LEU . 49.9 t90 -147.56 141.71 26.11 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.007 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -128.6 136.94 29.9 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.257 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.692 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 20.0 Cg_exo -64.75 158.22 51.83 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.566 2.177 . . . . 0.0 112.104 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -56.17 121.61 9.85 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.413 0.625 . . . . 0.0 112.099 -178.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.05 29.77 68.53 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.266 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.692 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 0.0 OUTLIER -113.64 136.47 52.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.034 0.417 . . . . 0.0 110.358 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.4 -16.51 42.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.372 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -109.64 138.21 46.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.689 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -82.97 120.39 25.64 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 8.3 p -96.88 -6.49 35.71 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.089 0.471 . . . . 0.0 110.957 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.614 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 11.1 mm -119.88 117.32 53.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.079 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.6 t -147.9 101.33 3.29 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.438 ' CD2' HG23 ' B' ' 43' ' ' ILE . 69.9 m-70 -122.13 128.99 51.94 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.463 ' O ' HG12 ' B' ' 50' ' ' ILE . 65.4 mmm -80.04 141.11 36.18 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.574 ' HB3' ' HA ' ' B' ' 100' ' ' LEU . 23.1 m-85 -56.15 -24.77 43.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.941 0.4 . . . . 0.0 110.95 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.65 -29.18 65.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.121 -179.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.602 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -89.8 -4.82 57.44 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.188 0.518 . . . . 0.0 110.592 -179.041 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.569 HD13 HD22 ' B' ' 69' ' ' LEU . 4.4 mm -88.34 128.86 40.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.459 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -85.39 -43.73 13.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.558 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.613 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 6.7 p -161.6 -177.82 6.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.733 -178.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -142.22 143.59 32.96 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.963 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.041 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 27.6 mttp -112.92 153.44 27.98 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.599 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -132.2 125.48 54.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.691 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -89.41 115.53 64.0 Favored Pre-proline 0 C--O 1.249 1.051 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -65.28 172.57 7.42 Favored 'Trans proline' 0 CA--C 1.518 -0.297 0 C-N-CA 125.155 3.903 . . . . 0.0 114.68 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.68 158.87 17.35 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.441 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.58 -29.16 8.04 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 109.841 -1.303 . . . . 0.0 109.841 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.539 ' HE3' ' O ' ' A' ' 399' ' ' GLU . 4.2 mttm -82.36 156.26 24.32 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 176.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.19 -18.5 61.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.64 0.733 . . . . 0.0 109.271 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.401 ' HB2' ' CD2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -134.41 119.63 18.81 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.585 -1.189 . . . . 0.0 111.104 -179.518 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.514 HG12 HG22 ' B' ' 86' ' ' VAL . 3.1 mp -72.74 134.57 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.474 HE21 ' HB2' ' B' ' 64' ' ' GLN . 11.0 mt-30 -137.5 163.32 31.43 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -176.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.484 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.2 tp -138.11 153.15 49.28 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 175.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.041 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -144.96 138.49 26.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 119.505 1.048 . . . . 0.0 111.478 179.043 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.898 HD11 HD13 ' B' ' 31' ' ' ILE . 94.7 mt -94.21 105.96 17.94 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.853 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.613 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -91.54 111.78 24.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.569 HD22 HD13 ' B' ' 50' ' ' ILE . 2.3 mt -100.34 158.65 15.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -176.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.602 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -77.49 -6.98 55.48 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.208 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.87 -7.79 52.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.727 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.4 15.04 57.81 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.814 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -126.22 155.46 41.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.996 0.427 . . . . 0.0 110.954 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.558 HG22 ' HA ' ' B' ' 68' ' ' VAL . 24.3 p -129.96 131.46 45.96 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.009 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.544 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 4.3 m -105.82 105.08 14.95 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.485 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.831 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.6 m-20 -82.09 137.65 34.98 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.548 0.689 . . . . 0.0 111.811 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.612 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.3 m-85 -125.57 102.5 7.4 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 114.653 -1.158 . . . . 0.0 108.724 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.627 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.4 t-160 -86.84 117.13 25.38 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.206 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.74 ' HE2' HG11 ' B' ' 12' ' ' VAL . 70.7 m-85 -83.28 94.84 8.0 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.595 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.46 1.05 54.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' B' ' 85' ' ' ALA . 0.2 OUTLIER -78.17 91.08 4.3 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.038 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.57 -35.4 3.94 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 19.3 m -60.7 -60.71 3.37 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -178.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 17.9 p -128.23 15.73 6.69 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.474 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.68 -46.3 7.36 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.651 HG12 ' HD2' ' B' ' 87' ' ' LYS . 24.3 t -58.32 -53.09 51.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 0.0 111.574 -179.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.651 ' HD2' HG12 ' B' ' 86' ' ' VAL . 0.0 OUTLIER -75.7 -25.15 56.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.623 -178.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.607 ' O ' HG23 ' B' ' 92' ' ' VAL . 16.0 mt-10 -67.26 -40.32 86.21 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 176.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.532 ' NE ' HD12 ' B' ' 55' ' ' ILE . 18.5 ttp180 -59.44 -45.89 90.29 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . 0.639 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 83.6 m-20 -58.69 -48.34 81.42 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.78 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.09 -42.03 94.45 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.956 HG13 HD11 ' B' ' 26' ' ' LEU . 60.9 t -62.02 -43.39 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 177.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.639 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 11.1 ttpp -58.92 -51.93 67.93 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.942 177.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -58.75 -54.31 48.5 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.889 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.74 ' HG ' HD12 ' B' ' 99' ' ' LEU . 11.5 tp -59.61 -38.85 82.37 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.705 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.76 -42.67 70.15 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.7 -24.3 67.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 122.383 1.087 . . . . 0.0 109.008 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -85.9 -47.94 9.19 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.934 -1.485 . . . . 0.0 111.425 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.74 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.5 mt -80.78 -43.02 20.79 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 115.189 1.552 . . . . 0.0 115.189 -176.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.642 ' HB2' ' HD3' ' B' ' 101' ' ' PRO . 24.7 mt -51.14 -59.89 6.76 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.642 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 29.6 Cg_exo -62.73 -16.07 50.75 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.012 1.808 . . . . 0.0 113.251 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 19.5 mtmm -78.69 -15.56 58.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 110.281 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -121.19 12.85 11.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.476 0.655 . . . . 0.0 109.548 179.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.614 ' HE3' ' HB3' ' A' ' 410' ' ' ASP . 17.1 mtpp -121.74 170.12 10.06 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.452 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.756 ' HA ' ' CZ ' ' B' ' 105' ' ' ARG . 0.0 OUTLIER 179.59 -41.82 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -179.731 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 410' ' ' ASP . 2.5 tptp 175.91 81.16 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.475 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -101.41 14.99 30.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.555 0.693 . . . . 0.0 110.102 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 . . . . . 0 C--O 1.244 0.814 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.255 -179.628 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.45 ' HB2' ' H ' ' A' ' 393' ' ' VAL . 5.6 p90 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . 0.45 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 24.6 t -70.44 121.26 19.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 89.1 -79.39 1.61 Allowed Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -99.66 149.98 22.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.931 0.395 . . . . 0.0 110.038 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.435 ' C ' ' H ' ' A' ' 398' ' ' GLU . 15.1 t70 -136.63 15.91 3.13 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.039 -179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.697 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 0.2 OUTLIER -76.55 16.43 0.49 Allowed 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.98 -179.367 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.697 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 2.7 mt-10 101.65 -72.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.868 1.667 . . . . 0.0 111.943 178.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.534 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 1.0 OUTLIER -141.97 116.55 9.68 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 120.788 0.327 . . . . 0.0 110.572 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.445 ' HB3' ' CD2' ' A' ' 403' ' ' PHE . 0.6 OUTLIER -141.14 83.27 1.87 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.267 -179.345 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.556 ' C ' ' H ' ' A' ' 403' ' ' PHE . 22.2 p-10 -138.25 -46.67 0.52 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' B' ' 60' ' ' LYS . 2.3 p30 -72.97 11.58 0.67 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 122.047 0.927 . . . . 0.0 110.017 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.907 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -60.51 115.77 3.83 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.514 179.062 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -107.71 130.99 54.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.741 -0.208 . . . . 0.0 111.554 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.429 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 1.6 pt-20 -108.76 -108.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . 0.704 HD21 ' HG2' ' A' ' 408' ' ' GLU . 1.0 OUTLIER -152.2 -176.67 5.77 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.741 179.522 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -70.92 -34.75 71.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -176.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.704 ' HG2' HD21 ' A' ' 406' ' ' ASN . 0.1 OUTLIER -73.33 163.91 27.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.634 0.73 . . . . 0.0 112.819 -177.773 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.849 ' HA ' ' HE3' ' B' ' 51' ' ' LYS . 11.7 t0 -149.74 54.52 0.94 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.624 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.406 ' OD2' ' HG3' ' B' ' 106' ' ' LYS . 4.0 t70 . . . . . 0 C--O 1.248 0.979 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.998 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 48.6 ttp . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.28 -31.75 15.28 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.86 -165.43 1.3 Allowed 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 114.22 -1.355 . . . . 0.0 108.563 178.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -55.83 18.85 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . 0.942 ' HB3' ' HB2' ' B' ' 29' ' ' GLU . 0.2 OUTLIER -179.58 54.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.351 178.339 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -112.39 -3.24 14.54 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.782 0.801 . . . . 0.0 110.438 -178.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.54 ' O ' ' HA ' ' B' ' 27' ' ' MET . 1.2 pm0 -75.55 102.02 5.11 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.829 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 62.9 t -81.73 120.95 34.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.112 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 27.9 mt -97.48 -31.83 12.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.93 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.2 tp -129.27 120.0 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.866 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.407 HG23 ' CE2' ' B' ' 25' ' ' TYR . 70.0 mt -103.9 120.93 54.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.939 -0.764 . . . . 0.0 108.939 177.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.833 HG21 HD23 ' B' ' 24' ' ' LEU . 3.3 t -111.27 149.31 14.06 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.383 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.576 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.5 mtmp? -113.86 179.32 3.99 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.543 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.499 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.48 72.04 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 O-C-N 125.328 1.642 . . . . 0.0 113.22 -178.155 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.576 HG23 ' O ' ' B' ' 13' ' ' LYS . 47.6 t -117.32 124.4 72.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.907 -1.042 . . . . 0.0 108.969 178.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.618 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.2 mtp180 -97.02 129.19 44.51 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.383 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.29 103.64 8.34 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 176.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.881 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 71.98 45.58 0.4 Allowed 'General case' 0 C--N 1.33 -0.243 0 O-C-N 123.767 0.667 . . . . 0.0 110.65 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.423 ' HA ' ' CZ ' ' B' ' 16' ' ' ARG . 0.0 OUTLIER 67.13 23.4 9.58 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.792 179.59 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 2.9 tp-100 -123.67 119.43 29.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.605 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.78 153.32 27.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.189 0.519 . . . . 0.0 112.349 -177.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -179.02 -154.49 13.02 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.602 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.45 132.1 48.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.917 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.8 tp -97.49 141.69 30.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . 0.407 ' CE2' HG23 ' B' ' 11' ' ' ILE . 37.4 m-85 -135.23 120.33 18.79 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.963 HD11 HG13 ' B' ' 92' ' ' VAL . 14.5 mt -99.94 116.24 31.53 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.03 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.54 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.8 mpt? -92.92 163.48 13.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.657 178.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.78 -39.9 62.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.942 ' HB2' ' HB3' ' B' ' 5' ' ' SER . 58.5 mp0 -110.48 -5.04 15.23 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.435 ' HG2' ' HB2' ' B' ' 5' ' ' SER . 14.4 ptt-85 -161.09 158.76 28.23 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 119.394 -0.922 . . . . 0.0 112.587 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.938 HD13 HD11 ' B' ' 67' ' ' LEU . 0.8 OUTLIER -105.83 128.98 59.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.126 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.455 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -129.91 153.6 48.17 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.9 0.381 . . . . 0.0 110.509 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.917 ' HB2' HD12 ' B' ' 24' ' ' LEU . 36.5 t90 -147.01 141.8 26.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.451 ' HB2' ' HA ' ' B' ' 41' ' ' PHE . . . -128.25 143.91 49.81 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.866 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 34' ' ' ALA . 17.3 Cg_exo -65.48 153.01 80.14 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 122.699 2.266 . . . . 0.0 111.354 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -65.32 116.11 6.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.963 0.411 . . . . 0.0 110.21 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.25 8.75 54.75 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.301 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.905 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 0.0 OUTLIER -105.04 144.8 31.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.689 0.757 . . . . 0.0 111.57 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.02 -22.31 27.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.172 -1.376 . . . . 0.0 111.523 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -122.13 150.29 42.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.019 0.438 . . . . 0.0 111.611 -178.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.451 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 16.0 m-85 -79.9 143.4 34.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.17 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -104.1 -25.31 13.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.141 0.496 . . . . 0.0 110.476 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.838 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 16.3 mm -104.01 124.95 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.385 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 8.6 t -148.14 101.73 3.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.502 ' CD2' HG23 ' B' ' 43' ' ' ILE . 60.2 m-70 -130.25 138.43 50.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.528 ' O ' HG12 ' B' ' 50' ' ' ILE . 30.6 mtp -90.83 145.28 24.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.635 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.0 m-85 -57.84 -24.1 55.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.667 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.63 -26.2 64.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.876 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.54 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.5 OUTLIER -95.96 -7.48 36.41 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.993 0.425 . . . . 0.0 110.735 -179.436 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.693 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.3 mm -86.9 127.44 40.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.849 ' HE3' ' HA ' ' A' ' 409' ' ' ASP . 0.2 OUTLIER -81.38 -40.38 23.57 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -179.178 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.537 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 31.8 p -173.28 -177.84 1.6 Allowed 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.459 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . 0.571 HE22 HD11 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -137.71 139.34 40.11 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.909 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.058 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -102.76 151.4 22.44 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.573 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -128.03 128.98 69.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 175.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.414 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -90.05 114.08 59.56 Favored Pre-proline 0 C--O 1.249 1.068 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 64.4 Cg_endo -68.67 172.94 10.71 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 125.103 3.869 . . . . 0.0 114.492 -177.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -58.98 157.86 9.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.035 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.32 -29.03 8.21 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.534 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 4.1 mttm -85.28 160.09 19.92 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.1 -13.35 59.35 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.695 ' HB3' ' CD2' ' B' ' 78' ' ' HIS . 0.0 OUTLIER -131.72 127.75 37.49 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.568 -179.329 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.598 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.0 mp -78.11 125.0 37.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 176.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -133.44 163.58 29.05 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -175.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.612 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -140.56 153.32 46.08 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 113.659 -1.609 . . . . 0.0 107.52 176.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.058 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.7 OUTLIER -146.62 145.48 30.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 119.273 0.942 . . . . 0.0 111.141 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.938 HD11 HD13 ' B' ' 31' ' ' ILE . 73.1 mt -96.27 106.22 18.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.026 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.581 ' HA ' HG22 ' B' ' 74' ' ' THR . 10.6 t -93.25 121.87 44.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.491 HD22 HD13 ' B' ' 50' ' ' ILE . 4.3 mt -108.36 154.35 21.96 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -177.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.54 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -75.34 -5.73 46.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.747 0.784 . . . . 0.0 108.94 178.274 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.43 -4.11 43.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.559 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.57 21.04 55.19 Favored Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.371 -0.692 . . . . 0.0 111.371 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -126.05 157.3 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.514 -0.343 . . . . 0.0 110.533 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.581 HG22 ' HA ' ' B' ' 68' ' ' VAL . 19.8 p -139.86 131.03 26.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.548 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.0 m -108.3 102.68 11.78 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.464 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -82.36 139.14 34.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.338 0.589 . . . . 0.0 111.637 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.838 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 53.5 m-85 -129.53 110.92 12.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.012 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.695 ' CD2' ' HB3' ' B' ' 62' ' ' LYS . 5.3 t-160 -87.51 121.24 29.7 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.01 179.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.727 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 42.4 m-85 -85.03 93.6 8.63 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.5 13.68 25.22 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.499 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.0 OUTLIER -86.08 94.27 9.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.316 0.579 . . . . 0.0 110.513 179.47 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.74 -31.05 1.81 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.05 -59.52 2.7 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -178.191 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.509 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 24.3 p -127.32 14.16 7.16 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -176.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -45.36 -49.66 12.83 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 t -59.14 -51.4 73.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 110.876 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.509 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.6 mttt -66.38 -34.53 78.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.054 0.454 . . . . 0.0 109.979 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.613 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -65.84 -44.81 84.39 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.598 ' HD3' HG23 ' B' ' 63' ' ' ILE . 23.1 ttp180 -55.61 -45.33 77.51 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . 0.733 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -63.56 -45.79 88.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.733 -1.576 . . . . 0.0 112.519 179.676 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.22 81.85 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.924 0.329 . . . . 0.0 111.421 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.963 HG13 HD11 ' B' ' 26' ' ' LEU . 45.3 t -62.79 -39.38 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 177.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.733 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.6 OUTLIER -62.17 -56.89 14.18 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.563 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . 0.4 ' O ' ' HG2' ' B' ' 98' ' ' GLN . 1.6 m-20 -54.09 -53.89 46.93 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.801 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.732 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.1 tp -61.64 -39.42 91.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.202 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.7 mt -69.47 -45.17 69.63 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 117.946 0.339 . . . . 0.0 110.366 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -64.24 -18.63 64.73 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.851 0.834 . . . . 0.0 109.475 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' B' ' 94' ' ' ASP . 27.9 mm-40 -85.88 -51.36 6.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.901 178.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.732 HD12 ' HG ' ' B' ' 95' ' ' LEU . 15.2 mt -76.0 -46.76 27.85 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.415 -1.721 . . . . 0.0 115.361 -176.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.693 HD22 ' HB ' ' B' ' 50' ' ' ILE . 31.5 mt -50.39 -60.15 5.85 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -61.74 -14.48 36.47 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.008 1.805 . . . . 0.0 113.146 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 20.3 mtmm -86.97 -14.51 41.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.762 -0.199 . . . . 0.0 111.17 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -117.3 -18.25 9.95 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.606 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 15.2 mtpt -60.93 108.55 0.88 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.806 0.336 . . . . 0.0 110.232 179.238 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.5 ' HA ' ' HE ' ' B' ' 105' ' ' ARG . 9.9 mmp_? -107.24 54.63 0.67 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.452 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.447 ' HB2' ' HE2' ' B' ' 106' ' ' LYS . 12.7 ptmm? -148.34 166.93 26.57 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.37 -0.377 . . . . 0.0 109.988 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -154.19 23.2 0.49 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.428 0.632 . . . . 0.0 109.486 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.0 t30 . . . . . 0 C--O 1.245 0.829 0 CA-C-N 114.591 -1.186 . . . . 0.0 108.773 -179.241 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.487 ' O ' ' HB ' ' A' ' 393' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.624 0.249 . . . . 0.0 111.036 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 93.2 t 78.09 123.38 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.058 0.543 . . . . 0.0 110.441 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 84.82 -57.88 5.0 Favored Glycine 0 CA--C 1.509 -0.317 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 -178.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -119.59 113.81 21.27 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 106.519 -1.66 . . . . 0.0 106.519 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -134.39 31.8 3.43 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.722 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 27.8 t70 -40.54 -34.99 0.4 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 174.28 -86.28 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.848 0.356 . . . . 0.0 111.454 178.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.989 ' HG2' ' HE2' ' B' ' 62' ' ' LYS . 3.9 pt-20 -120.47 112.87 19.5 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.906 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.0 OUTLIER -143.55 84.53 1.8 Allowed 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 120.132 -0.627 . . . . 0.0 112.537 -177.244 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.519 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.7 p-10 -139.15 -45.67 0.47 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -72.37 11.06 0.65 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 110.271 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.923 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -58.02 112.55 1.55 Allowed 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.414 179.24 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -99.69 135.93 40.38 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.411 -177.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.998 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 17.9 pt-20 -143.07 161.67 37.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.585 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . 0.536 ' HA ' ' OE1' ' A' ' 408' ' ' GLU . 1.1 t-20 -169.95 35.42 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -112.94 -6.43 13.77 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.404 -1.271 . . . . 0.0 109.7 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.578 ' HA ' ' HB3' ' B' ' 52' ' ' CYS . 5.5 pm0 -60.38 144.78 50.04 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 -178.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.623 ' OD1' ' HG3' ' B' ' 51' ' ' LYS . 18.1 p-10 -103.99 -166.09 1.22 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 105.935 -1.876 . . . . 0.0 105.935 175.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 . . . . . 0 C--N 1.314 -0.958 0 CA-C-N 118.681 0.673 . . . . 0.0 110.173 179.646 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 49.7 ttp . . . . . 0 N--CA 1.476 0.875 0 CA-C-O 120.505 0.193 . . . . 0.0 110.828 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.74 -77.85 0.05 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.962 0.411 . . . . 0.0 110.803 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 19.9 m -155.52 105.29 2.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.818 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 7.8 m 62.12 29.98 17.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.253 0.549 . . . . 0.0 110.55 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.0 95.11 2.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.336 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 70.5 41.6 0.95 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 122.013 0.911 . . . . 0.0 108.543 -178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.551 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.2 OUTLIER -96.77 102.99 14.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.094 -179.632 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 88.5 t -81.76 114.01 22.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.533 HD12 HD11 ' B' ' 99' ' ' LEU . 22.7 mt -95.29 -29.01 14.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.264 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.454 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -137.4 137.3 38.67 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 75.5 mt -122.85 115.96 47.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.716 HG21 HD23 ' B' ' 24' ' ' LEU . 3.0 t -104.93 149.25 8.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.09 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.535 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -108.08 173.21 6.42 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.57 -179.177 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.59 ' HE3' ' HA ' ' B' ' 81' ' ' ASN . 22.1 mtmt 18.23 82.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 125.341 1.651 . . . . 0.0 113.471 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.535 HG23 ' O ' ' B' ' 13' ' ' LYS . 31.6 t -129.02 123.6 59.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.186 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.634 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 6.8 mtp-105 -98.61 141.27 31.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.213 0.53 . . . . 0.0 112.22 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -132.5 103.43 6.17 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 177.096 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.646 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 59.4 mttp 65.09 56.54 1.02 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.457 -1.247 . . . . 0.0 112.026 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.722 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 2.8 mptp? 68.83 23.93 6.69 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.155 177.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.554 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 10.4 tt0 -135.83 119.72 17.41 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.65 -179.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -81.94 153.15 26.42 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.821 0.344 . . . . 0.0 111.72 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.672 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -177.38 -158.36 20.33 Favored Glycine 0 CA--C 1.521 0.433 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.186 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.42 136.83 54.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.126 0.488 . . . . 0.0 110.648 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.946 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.3 139.7 35.61 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.128 -178.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.45 125.72 29.63 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.899 HD11 HG13 ' B' ' 92' ' ' VAL . 16.9 mt -107.94 117.34 33.87 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.476 -0.489 . . . . 0.0 111.128 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.551 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.2 mpt? -97.49 159.68 14.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.14 -27.83 55.64 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.101 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.976 ' HA ' ' HE2' ' B' ' 103' ' ' PHE . 0.9 OUTLIER -103.07 -25.12 13.53 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.13 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.492 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.1 OUTLIER -157.97 169.86 23.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.915 -175.989 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.916 HD13 HD11 ' B' ' 67' ' ' LEU . 1.5 tt -110.79 122.14 64.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.661 178.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.459 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -123.17 149.82 44.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.011 0.434 . . . . 0.0 110.599 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.946 ' HB2' HD12 ' B' ' 24' ' ' LEU . 39.7 t90 -146.68 134.07 20.75 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.466 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -122.92 131.46 24.36 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.334 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.672 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 9.3 Cg_exo -70.3 160.0 51.08 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.536 2.157 . . . . 0.0 111.353 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.62 145.26 55.78 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.918 0.39 . . . . 0.0 109.972 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.35 24.87 74.93 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.555 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' B' ' 38' ' ' LYS . 25.3 mmtm -114.19 153.36 29.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.587 0.232 . . . . 0.0 110.579 179.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -106.39 5.02 29.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.556 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -151.73 160.18 43.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.24 -179.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -86.1 125.71 33.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.083 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 3.0 p -90.64 -22.48 21.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.29 0.567 . . . . 0.0 110.328 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.638 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 17.8 mm -107.46 118.62 55.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.111 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -147.93 101.58 3.31 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.477 ' O ' ' HB2' ' B' ' 30' ' ' ARG . 59.1 m-70 -127.74 134.87 49.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.281 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.494 ' O ' HG12 ' B' ' 50' ' ' ILE . 84.0 mmm -84.79 143.07 29.35 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.708 ' HB2' ' HD2' ' B' ' 103' ' ' PHE . 22.7 m-30 -57.28 -22.69 43.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.83 0.348 . . . . 0.0 111.294 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.19 -26.87 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.893 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.617 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.6 OUTLIER -94.28 -4.21 49.19 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.976 0.417 . . . . 0.0 110.6 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.619 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.7 mm -90.35 128.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.623 ' HG3' ' OD1' ' A' ' 409' ' ' ASP . 51.4 tttp -85.43 -40.68 16.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.396 0.617 . . . . 0.0 109.452 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.592 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 3.8 p -168.59 -177.62 3.18 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.291 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -143.06 139.57 30.56 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.313 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.998 ' HG2' ' HB3' ' A' ' 405' ' ' GLU . 53.2 mttp -106.99 161.44 14.72 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.668 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -133.07 130.15 57.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 175.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.6 p -91.27 118.0 68.2 Favored Pre-proline 0 C--O 1.25 1.086 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.66 173.08 11.4 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 124.966 3.778 . . . . 0.0 114.011 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -59.95 160.84 7.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.161 178.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.23 -28.76 8.09 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -177.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.553 ' HE3' ' HB2' ' A' ' 399' ' ' GLU . 14.5 mttp -89.52 158.29 17.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 176.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.96 -5.71 42.95 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.241 0.543 . . . . 0.0 110.485 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.989 ' HE2' ' HG2' ' A' ' 399' ' ' GLU . 0.7 OUTLIER -142.78 146.69 34.49 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.049 -179.558 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.697 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -90.61 131.47 37.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.53 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 24.5 mt-30 -131.9 163.16 28.93 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.526 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.7 tp -140.82 153.45 45.8 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.417 -1.719 . . . . 0.0 106.642 175.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 0.942 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.47 142.39 28.05 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 119.149 0.886 . . . . 0.0 111.875 179.135 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.916 HD11 HD13 ' B' ' 31' ' ' ILE . 89.6 mt -94.33 104.49 16.47 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.928 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.664 ' HA ' HG22 ' B' ' 74' ' ' THR . 4.1 t -90.14 114.39 27.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.548 HD22 HD13 ' B' ' 50' ' ' ILE . 4.0 mt -100.75 155.64 17.8 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -177.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.617 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -77.69 -3.46 41.23 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.279 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.94 -7.33 56.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.259 179.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.04 17.59 50.49 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.866 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -126.25 160.29 30.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.698 0.285 . . . . 0.0 110.8 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.664 HG22 ' HA ' ' B' ' 68' ' ' VAL . 21.2 p -137.71 131.73 31.79 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.552 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.4 m -106.48 109.57 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.41 0.148 . . . . 0.0 111.302 -179.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.906 HD21 ' HB3' ' A' ' 400' ' ' ASP . 5.6 m-20 -82.29 147.29 28.97 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.742 0.782 . . . . 0.0 112.19 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.638 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 43.1 m-85 -134.51 103.5 5.71 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.743 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.634 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.6 t-160 -86.46 107.78 18.22 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.513 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.672 ' CE2' HG11 ' B' ' 12' ' ' VAL . 54.2 m-85 -76.26 94.37 3.55 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.158 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.04 5.16 47.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.891 -178.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.59 ' HA ' ' HE3' ' B' ' 14' ' ' LYS . 46.4 t30 -85.98 91.13 8.29 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.448 ' CD ' ' H ' ' B' ' 82' ' ' GLU . 0.7 OUTLIER -51.66 -29.09 16.61 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.543 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 2.1 m -60.13 -60.21 4.18 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.512 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.9 p -128.34 12.76 6.54 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.55 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.7 -50.04 7.68 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.417 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -58.34 -52.44 59.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.848 0.356 . . . . 0.0 110.869 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.512 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.4 mttt -66.4 -37.33 84.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.052 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.686 ' O ' HG23 ' B' ' 92' ' ' VAL . 13.8 mt-10 -63.95 -43.55 95.49 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.697 ' HD3' HG23 ' B' ' 63' ' ' ILE . 28.4 ttp180 -56.63 -49.67 74.29 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . 0.541 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -59.85 -43.3 94.7 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.635 -1.62 . . . . 0.0 112.225 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.14 -43.47 74.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.675 0.216 . . . . 0.0 111.27 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.899 HG13 HD11 ' B' ' 26' ' ' LEU . 40.2 t -61.02 -42.72 94.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.668 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.3 tmmt? -59.34 -58.66 7.65 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.722 178.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.31 -53.91 44.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.158 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.549 ' HG ' ' CD1' ' B' ' 99' ' ' LEU . 10.7 tp -62.12 -37.13 83.95 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.182 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.456 HD12 HG12 ' B' ' 92' ' ' VAL . 26.0 mt -73.34 -41.01 63.97 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.7 -19.96 59.93 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.197 0.998 . . . . 0.0 108.971 178.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -93.86 -51.9 4.68 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.813 -1.54 . . . . 0.0 111.043 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.657 ' HB3' ' CE1' ' B' ' 47' ' ' TYR . 42.4 mt -75.75 -28.41 58.48 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.494 -1.685 . . . . 0.0 115.432 -176.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.619 HD22 ' HB ' ' B' ' 50' ' ' ILE . 36.4 mt -72.5 -58.18 3.08 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 18.6 Cg_endo -57.59 -19.18 35.98 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.542 2.162 . . . . 0.0 114.178 -177.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' B' ' 99' ' ' LEU . 17.9 pttm -80.5 -11.98 59.6 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.172 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.976 ' HE2' ' HA ' ' B' ' 29' ' ' GLU . 17.5 m-30 -124.09 -0.16 8.4 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.772 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' B' ' 100' ' ' LEU . 81.7 mttt -67.94 100.57 0.98 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.529 0.68 . . . . 0.0 112.182 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 53.0 ttp85 -107.44 11.52 28.83 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.694 178.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp 73.03 0.36 3.66 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.049 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -178.42 -176.44 0.5 Allowed 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.454 -1.248 . . . . 0.0 107.941 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.84 -0.6 . . . . 0.0 109.683 179.649 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.59 ' HD2' ' HB2' ' A' ' 396' ' ' ASP . 63.0 t80 . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 120.741 0.305 . . . . 0.0 111.049 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 22.3 t -134.13 -84.11 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -89.29 -27.17 23.72 Favored Glycine 0 CA--C 1.505 -0.57 0 N-CA-C 107.345 -2.302 . . . . 0.0 107.345 176.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 392' ' ' TYR . 0.0 OUTLIER -146.55 -167.53 2.78 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 177.755 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.59 ' HB2' ' HD2' ' A' ' 392' ' ' TYR . 41.4 t0 -136.56 30.37 2.89 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 119.122 -1.031 . . . . 0.0 111.756 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.576 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 0.5 OUTLIER -62.91 -26.69 68.92 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 119.255 -0.978 . . . . 0.0 108.382 177.825 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.75 ' HB3' ' HE3' ' B' ' 62' ' ' LYS . 3.1 tt0 167.48 -78.46 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.551 177.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.879 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 57.7 tt0 -135.27 103.11 5.39 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -178.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.607 ' HB3' HD21 ' B' ' 76' ' ' ASN . 0.2 OUTLIER -135.94 91.27 2.67 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.09 -45.22 0.47 Allowed 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -72.05 8.22 1.35 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.269 0.557 . . . . 0.0 110.774 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.994 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.3 OUTLIER -52.99 120.05 5.39 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.75 179.426 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -99.96 142.59 31.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.352 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -127.2 150.72 49.4 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.165 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -158.54 23.22 0.23 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.066 0.46 . . . . 0.0 110.818 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . 0.622 ' OD1' ' HB3' ' B' ' 52' ' ' CYS . 1.2 t70 -93.25 -24.63 18.1 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.298 -178.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.495 ' O ' ' HB2' ' A' ' 409' ' ' ASP . 3.9 mm-40 52.16 -114.67 0.84 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -178.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.495 ' HB2' ' O ' ' A' ' 408' ' ' GLU . 0.8 OUTLIER 167.98 -57.01 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.429 0 O-C-N 123.782 0.676 . . . . 0.0 109.959 177.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.903 -1.046 . . . . 0.0 109.782 179.205 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.4 tpt . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.47 -74.04 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.42 -48.1 3.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.352 0.596 . . . . 0.0 109.458 178.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 28.3 m -159.27 100.5 1.52 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . 0.493 ' HB3' ' HB2' ' B' ' 29' ' ' GLU . 0.0 OUTLIER -143.56 34.39 1.29 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.724 0.297 . . . . 0.0 111.212 -178.76 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 mp0 -129.88 18.34 5.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.763 0.792 . . . . 0.0 109.829 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.527 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -119.54 117.09 27.46 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.209 -178.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -82.53 117.44 28.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.009 0.433 . . . . 0.0 110.755 -179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.3 mt -95.67 -31.66 13.14 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.301 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.457 HD23 ' HG ' ' B' ' 26' ' ' LEU . 6.4 tp -131.37 129.3 41.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.923 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 73.1 mt -113.82 122.68 68.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.859 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.6 t -113.59 150.27 15.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.634 ' O ' HG23 ' B' ' 15' ' ' VAL . 1.7 mtmp? -116.67 178.6 4.28 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.441 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 1.2 mmtm 18.45 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 O-C-N 125.2 1.562 . . . . 0.0 113.422 -178.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.634 HG23 ' O ' ' B' ' 13' ' ' LYS . 24.7 t -124.01 125.11 70.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.139 179.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.644 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 1.8 mpt_? -93.75 132.78 37.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.92 0.39 . . . . 0.0 110.629 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.416 ' HG3' HG13 ' B' ' 43' ' ' ILE . 5.2 tm0? -129.59 113.74 15.19 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.475 ' HD3' ' HA ' ' B' ' 18' ' ' LYS . 0.5 OUTLIER 66.4 41.03 3.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.952 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.478 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 2.2 mptp? 68.52 29.94 5.4 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.051 179.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 7.6 tp-100 -131.23 126.64 36.02 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.569 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.533 ' CG ' ' HE ' ' B' ' 16' ' ' ARG . 9.3 t0 -73.95 146.57 43.8 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 -179.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.634 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -179.1 -164.69 32.18 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.656 -0.783 . . . . 0.0 113.84 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.46 136.6 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.182 0.593 . . . . 0.0 109.43 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.932 HD12 ' HB2' ' B' ' 33' ' ' TRP . 5.9 tp -99.13 143.64 29.17 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.993 -178.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -137.57 115.56 11.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.82 0.343 . . . . 0.0 110.173 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.96 HD11 HG13 ' B' ' 92' ' ' VAL . 13.0 mt -94.25 128.41 40.69 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.772 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.527 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 18.8 mtt -106.44 167.98 9.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.775 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.87 65.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -176.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.493 ' HB2' ' HB3' ' B' ' 5' ' ' SER . 61.0 mt-10 -121.67 4.31 10.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.46 ' HB3' ' SD ' ' B' ' 46' ' ' MET . 0.2 OUTLIER -157.84 156.59 31.71 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 119.29 -0.964 . . . . 0.0 112.68 -177.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.973 HD13 HD11 ' B' ' 67' ' ' LEU . 1.0 OUTLIER -109.08 120.86 61.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.202 -0.908 . . . . 0.0 108.592 178.449 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.446 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -121.04 150.57 40.97 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.495 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.932 ' HB2' HD12 ' B' ' 24' ' ' LEU . 29.7 t90 -147.12 135.53 21.79 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.44 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -123.74 134.41 25.29 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.137 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 1.051 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 3.2 Cg_exo -72.48 144.93 41.47 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 122.314 2.01 . . . . 0.0 111.591 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.491 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 32.2 mt-10 -64.45 129.24 39.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.157 0.503 . . . . 0.0 110.648 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.5 1.38 64.17 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.05 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 1.051 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 5.0 mptt -113.34 151.64 30.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.632 0.253 . . . . 0.0 110.327 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -100.15 8.09 44.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.887 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -138.97 151.67 47.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.131 0.491 . . . . 0.0 112.077 -178.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 65.2 m-85 -86.0 121.36 28.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.585 179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -16.12 29.24 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.232 0.539 . . . . 0.0 110.529 179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.669 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 18.9 mm -113.65 118.91 59.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.752 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 28.3 t -148.03 101.21 3.27 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.483 ' CD2' HG23 ' B' ' 43' ' ' ILE . 54.5 m-70 -128.12 138.58 52.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.537 ' O ' HG12 ' B' ' 50' ' ' ILE . 61.6 mmm -88.33 143.64 26.89 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.2 m-85 -59.84 -21.71 61.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 110.305 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.15 -15.3 61.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.482 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.574 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -103.33 -10.48 18.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.29 0.567 . . . . 0.0 109.52 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.691 ' HB ' HD22 ' B' ' 100' ' ' LEU . 1.6 mm -90.31 126.29 43.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.445 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 0.1 OUTLIER -86.67 -41.0 14.56 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.286 0.565 . . . . 0.0 110.063 -179.085 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.635 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 1.8 p -160.71 -177.83 6.44 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.574 -179.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.48 140.47 26.25 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.798 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.046 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 36.7 mttp -105.15 156.85 17.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.743 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -132.08 126.85 57.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.414 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.7 p -90.52 118.88 69.06 Favored Pre-proline 0 C--O 1.247 0.935 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.54 172.8 11.78 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 124.67 3.58 . . . . 0.0 114.34 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -60.79 160.99 8.58 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.326 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.52 -29.19 7.72 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -177.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.879 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.4 mttp -89.03 146.69 24.69 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 175.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.73 -4.22 18.82 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.359 0.599 . . . . 0.0 110.392 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.75 ' HE3' ' HB3' ' A' ' 398' ' ' GLU . 16.1 pttm -139.54 125.6 19.87 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.181 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mp -78.21 137.69 21.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -136.4 163.2 31.02 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.578 HD13 ' HG2' ' B' ' 89' ' ' ARG . 1.1 tp -141.66 153.44 44.72 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 113.578 -1.646 . . . . 0.0 107.442 177.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.046 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.29 143.62 30.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 178.65 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.973 HD11 HD13 ' B' ' 31' ' ' ILE . 97.1 mt -97.62 106.01 18.25 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.969 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.635 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 18.5 t -90.35 111.82 23.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.483 HD22 HD13 ' B' ' 50' ' ' ILE . 6.6 mt -93.98 156.5 16.58 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.081 0.467 . . . . 0.0 112.203 -177.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.574 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.66 -3.45 44.11 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.247 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.26 -4.59 53.86 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.578 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.36 19.98 53.42 Favored Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -126.09 158.23 35.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.564 -0.318 . . . . 0.0 110.406 -179.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.609 HG22 ' HA ' ' B' ' 68' ' ' VAL . 16.6 p -136.0 131.53 35.13 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.564 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 6.6 m -107.23 108.47 19.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.188 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.607 HD21 ' HB3' ' A' ' 400' ' ' ASP . 4.8 m-20 -82.13 154.66 25.42 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.291 0.567 . . . . 0.0 112.001 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.669 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 44.3 m-85 -140.5 111.39 6.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.979 -1.009 . . . . 0.0 109.511 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.644 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.2 t-160 -88.56 104.84 17.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.607 -179.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.649 ' HZ ' HG21 ' B' ' 92' ' ' VAL . 41.6 m-85 -80.43 108.98 14.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 4.4 p -116.7 5.87 13.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.488 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.6 t-20 -77.8 91.62 4.13 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.242 -0.583 . . . . 0.0 109.807 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.55 -38.64 1.38 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.966 0.906 . . . . 0.0 113.367 -178.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -58.26 -59.66 4.98 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.537 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.82 9.01 6.35 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -176.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.466 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.52 -48.3 7.38 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -177.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 3.9 t -59.43 -52.61 58.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.824 0.345 . . . . 0.0 110.644 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.537 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 6.4 mttt -67.01 -32.67 74.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.152 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.656 ' O ' HG23 ' B' ' 92' ' ' VAL . 11.5 mt-10 -65.46 -46.12 81.07 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.633 ' HD3' ' HB ' ' B' ' 55' ' ' ILE . 4.1 tmm_? -57.94 -40.78 81.34 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . 0.538 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 1.6 m-20 -64.91 -47.36 78.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.016 179.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.35 -43.57 81.17 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.96 HG13 HD11 ' B' ' 26' ' ' LEU . 41.5 t -61.0 -41.17 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 177.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.743 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.5 tmmt? -61.32 -57.25 13.1 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.414 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -55.8 15.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.143 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.811 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.1 tp -62.04 -31.19 71.57 Favored 'General case' 0 C--O 1.215 -0.735 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.568 -178.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 23.0 mt -78.63 -43.99 24.95 Favored 'General case' 0 C--O 1.218 -0.6 0 O-C-N 122.219 -0.301 . . . . 0.0 110.749 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' B' ' 93' ' ' LYS . 21.0 mt-30 -65.56 -17.85 64.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.098 0.951 . . . . 0.0 108.87 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -87.61 -49.56 7.09 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.117 -1.401 . . . . 0.0 110.63 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.811 HD12 ' HG ' ' B' ' 95' ' ' LEU . 12.4 mt -81.49 -33.49 31.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 115.401 1.63 . . . . 0.0 115.401 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.718 HD23 ' HB3' ' B' ' 47' ' ' TYR . 58.8 mt -66.82 -57.27 11.95 Favored Pre-proline 0 C--N 1.317 -0.814 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.637 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 39.4 Cg_exo -58.73 -20.62 52.13 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.399 2.066 . . . . 0.0 114.211 -178.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.805 ' HB2' ' HB3' ' B' ' 108' ' ' ASN . 7.2 ptmm? -81.77 -19.72 40.7 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.537 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.445 ' HD1' ' HB2' ' B' ' 47' ' ' TYR . 24.0 m-85 -105.01 -35.97 7.47 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.428 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.566 ' HG2' ' HA ' ' B' ' 101' ' ' PRO . 51.3 pttt -77.05 122.38 24.87 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 177.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' B' ' 104' ' ' LYS . 62.5 mtt180 73.72 -5.8 1.93 Allowed 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -177.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.419 ' H ' ' C ' ' B' ' 104' ' ' LYS . 9.2 tptp 54.58 71.24 0.54 Allowed 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.367 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' B' ' 108' ' ' ASN . . . -97.26 10.48 39.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.303 0.573 . . . . 0.0 110.408 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.805 ' HB3' ' HB2' ' B' ' 102' ' ' LYS . 7.0 t-20 . . . . . 0 C--O 1.251 1.153 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.422 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.71 ' HA ' ' OD1' ' A' ' 400' ' ' ASP . 7.8 t80 . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 392' ' ' TYR . 68.9 t 84.69 -35.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.721 0.808 . . . . 0.0 110.73 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . -77.46 -35.42 37.09 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.021 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 1.012 ' HG2' ' HB2' ' B' ' 76' ' ' ASN . 5.5 tp10 -139.49 159.43 42.18 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.631 ' OD1' ' HE3' ' B' ' 18' ' ' LYS . 0.5 OUTLIER -101.52 10.29 40.48 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.877 ' H ' ' HG3' ' A' ' 395' ' ' GLU . 0.5 OUTLIER -64.68 17.39 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -177.719 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.678 ' HG3' ' HD2' ' B' ' 19' ' ' LYS . 81.5 mt-10 91.18 -41.92 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.72 1.208 . . . . 0.0 112.27 178.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.842 ' HB2' ' HE2' ' B' ' 62' ' ' LYS . 1.5 mt-10 -151.36 150.36 30.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.726 0.298 . . . . 0.0 111.799 -178.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.885 ' HB3' HD21 ' B' ' 76' ' ' ASN . 9.6 p-10 177.86 77.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.643 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.49 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.0 OUTLIER -137.98 -51.19 0.6 Allowed 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.412 -0.805 . . . . 0.0 112.964 -178.256 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.53 9.85 0.97 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.315 0.579 . . . . 0.0 110.331 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.912 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -51.92 127.3 20.75 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.183 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -97.34 134.53 40.49 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.85 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.49 ' CD ' ' HZ2' ' B' ' 54' ' ' LYS . 9.6 tt0 -128.48 140.11 51.98 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.337 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' ' 406' ' ' ASN . 1.5 t-20 -167.36 42.58 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.734 179.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . 0.489 ' HB3' ' HB2' ' B' ' 52' ' ' CYS . 6.8 t70 -112.24 -32.8 6.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.235 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.46 ' HB3' ' H ' ' A' ' 409' ' ' ASP . 0.5 OUTLIER 44.78 -149.24 0.07 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.995 179.11 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.46 ' H ' ' HB3' ' A' ' 408' ' ' GLU . 0.0 OUTLIER 169.93 -36.15 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.049 179.415 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.479 ' HA ' ' CE ' ' B' ' 106' ' ' LYS . 3.3 m-20 . . . . . 0 C--O 1.253 1.282 0 CA-C-O 117.864 -1.065 . . . . 0.0 111.299 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.694 ' HG3' ' HG2' ' B' ' 6' ' ' GLU . 18.3 ptm . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . 0.605 ' HA ' ' NH2' ' B' ' 30' ' ' ARG . . . -86.05 113.16 21.91 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.919 0.39 . . . . 0.0 111.495 -179.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 26.3 m -145.93 -57.24 0.3 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.447 178.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.454 ' H ' ' CD ' ' B' ' 6' ' ' GLU . 3.0 p -152.25 -80.15 0.1 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.995 0.426 . . . . 0.0 110.604 179.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 22.8 m -137.85 82.53 1.92 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.694 ' HG2' ' HG3' ' B' ' 1' ' ' MET . 18.5 mp0 -102.08 -133.35 0.29 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.438 -177.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.411 ' O ' ' HA ' ' B' ' 27' ' ' MET . 5.8 mp0 -45.88 101.73 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 45.5 t -94.63 108.21 20.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.71 -29.56 25.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.617 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.439 HD23 ' HG ' ' B' ' 26' ' ' LEU . 7.2 tp -136.12 132.76 36.5 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 60.3 mt -117.2 120.79 66.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.803 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 4.9 t -112.75 148.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.406 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.593 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -109.47 175.95 5.26 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.285 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.566 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 0.1 OUTLIER 18.17 78.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 O-C-N 125.422 1.701 . . . . 0.0 113.667 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.593 HG23 ' O ' ' B' ' 13' ' ' LYS . 25.8 t -129.04 125.54 62.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.798 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.629 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 38.6 mtp180 -99.68 138.2 37.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.245 0.545 . . . . 0.0 111.502 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.416 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -124.92 114.27 18.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.646 -1.613 . . . . 0.0 106.646 176.714 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.631 ' HE3' ' OD1' ' A' ' 396' ' ' ASP . 0.0 OUTLIER 68.64 31.34 4.68 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -178.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.678 ' HD2' ' HG3' ' A' ' 398' ' ' GLU . 0.0 OUTLIER 76.24 13.06 2.63 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 114.343 -1.298 . . . . 0.0 112.148 -179.763 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.629 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 5.7 tp-100 -105.85 118.9 37.79 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -77.27 149.98 35.36 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 -177.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.731 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -178.39 -155.39 14.3 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.817 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.85 137.6 51.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.139 0.495 . . . . 0.0 110.156 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 1.0 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.47 138.97 34.09 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.006 -178.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -134.06 110.14 9.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.68 0.276 . . . . 0.0 110.338 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.92 HD11 HG13 ' B' ' 92' ' ' VAL . 10.8 mt -87.71 129.0 35.3 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.069 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.411 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 21.7 mtt -109.27 169.1 8.91 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.968 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.88 -50.61 14.22 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -115.29 6.53 14.96 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.605 ' NH2' ' HA ' ' B' ' 2' ' ' ALA . 0.7 OUTLIER -158.42 157.6 32.58 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 119.532 -0.867 . . . . 0.0 112.86 -178.083 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.87 HD13 HD11 ' B' ' 67' ' ' LEU . 1.3 tt -106.77 116.47 50.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 178.049 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -117.97 151.75 36.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.988 0.423 . . . . 0.0 111.044 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 1.0 ' HB2' HD12 ' B' ' 24' ' ' LEU . 47.4 t90 -147.14 136.41 22.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.873 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.47 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -125.73 133.22 24.69 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.382 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 1.001 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 5.6 Cg_exo -74.81 148.68 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.596 2.197 . . . . 0.0 111.62 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.572 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 73.5 mt-10 -65.54 130.86 44.8 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.102 0.477 . . . . 0.0 110.829 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.03 2.19 62.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.129 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 1.001 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 4.3 mptt -113.28 148.89 34.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.691 0.281 . . . . 0.0 110.337 179.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -98.06 5.86 48.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.603 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -141.34 152.83 44.74 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.158 0.504 . . . . 0.0 111.844 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -82.98 122.87 28.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.902 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 2.0 p -90.87 -18.61 24.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.31 0.576 . . . . 0.0 110.532 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.626 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 18.1 mm -112.49 117.84 56.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.392 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 25.9 t -148.06 101.46 3.29 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.464 ' CD2' HG23 ' B' ' 43' ' ' ILE . 48.8 m-70 -125.11 138.04 54.17 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.986 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.504 ' O ' HG12 ' B' ' 50' ' ' ILE . 67.5 mmm -87.94 143.54 27.05 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 178.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.718 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.5 m-85 -58.73 -21.86 56.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.907 0.384 . . . . 0.0 110.516 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.91 -13.1 60.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.679 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.599 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -105.4 -10.67 16.83 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.321 0.582 . . . . 0.0 109.586 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.618 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.6 mm -89.37 127.21 42.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.445 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 21.9 tttp -84.8 -44.53 13.19 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 407' ' ' ASP . 1.8 p -161.29 -178.03 6.42 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.052 -0.976 . . . . 0.0 108.731 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -144.49 142.15 30.06 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.259 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.133 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 28.6 mttp -108.61 155.26 20.88 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.704 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.51 127.65 62.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 176.447 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.432 ' HA ' ' HD2' ' B' ' 57' ' ' PRO . 2.8 p -90.64 116.91 67.46 Favored Pre-proline 0 C--O 1.249 1.029 0 C-N-CA 120.016 -0.674 . . . . 0.0 109.432 -179.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' B' ' 56' ' ' SER . 73.6 Cg_endo -69.36 173.37 10.72 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 125.24 3.96 . . . . 0.0 113.767 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -58.38 160.33 5.36 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.647 -1.16 . . . . 0.0 110.092 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.04 -29.2 7.87 Favored Glycine 0 C--N 1.315 -0.605 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.776 ' HE3' ' HB3' ' A' ' 399' ' ' GLU . 6.7 mttm -88.66 152.92 21.51 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.4 -9.11 55.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.335 0.588 . . . . 0.0 110.456 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.842 ' HE2' ' HB2' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -139.65 141.98 37.02 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.689 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.693 HG23 ' HD3' ' B' ' 89' ' ' ARG . 2.4 mp -83.85 130.19 36.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.478 HE21 ' HB2' ' B' ' 64' ' ' GLN . 3.6 mt-30 -132.05 162.78 29.94 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 118.805 -1.158 . . . . 0.0 113.851 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.432 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 2.0 tp -139.91 153.56 47.0 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.851 -1.522 . . . . 0.0 107.272 177.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.133 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.8 OUTLIER -145.97 138.21 25.35 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.311 178.869 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.87 HD11 HD13 ' B' ' 31' ' ' ILE . 71.8 mt -94.17 104.94 16.94 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.501 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.736 ' HA ' HG22 ' B' ' 74' ' ' THR . 10.7 t -89.09 109.07 19.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.532 HD22 HD13 ' B' ' 50' ' ' ILE . 2.3 mt -93.82 157.26 16.22 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.985 -177.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -81.31 1.04 34.39 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.232 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -16.17 59.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.548 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 104.25 7.59 40.15 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.939 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.498 ' OD1' HD12 ' B' ' 69' ' ' LEU . 8.7 p-10 -126.37 170.42 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.206 0.527 . . . . 0.0 111.859 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.736 HG22 ' HA ' ' B' ' 68' ' ' VAL . 8.8 p -137.57 131.93 32.39 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.763 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 9.6 m -103.98 112.56 25.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.73 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 1.012 ' HB2' ' HG2' ' A' ' 395' ' ' GLU . 4.8 m-20 -84.51 153.87 23.04 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.628 0.728 . . . . 0.0 112.164 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.572 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 36.7 m-85 -133.62 111.86 10.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.573 178.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.556 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 1.7 t60 -86.59 98.97 11.38 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.701 -177.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.805 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 41.8 m-85 -77.06 95.57 4.23 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.42 4.97 44.2 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.566 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.7 t-20 -80.3 91.35 5.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.125 0.488 . . . . 0.0 110.297 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.18 -42.1 4.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.325 -0.852 . . . . 0.0 113.173 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -59.75 4.72 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 18.1 p -127.62 8.75 6.43 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.805 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.75 -47.93 7.99 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -178.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.436 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.2 t -59.11 -52.03 65.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.845 0.355 . . . . 0.0 111.016 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.575 ' H ' ' HD2' ' B' ' 87' ' ' LYS . 6.4 mptt -67.67 -35.09 78.21 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.036 0.446 . . . . 0.0 109.817 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.672 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.0 mt-10 -64.75 -44.79 88.97 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.693 ' HD3' HG23 ' B' ' 63' ' ' ILE . 28.3 ttp180 -54.55 -47.64 72.97 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . 0.673 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -61.94 -44.86 95.9 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 113.655 -1.611 . . . . 0.0 112.293 179.687 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.39 -41.43 80.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 117.79 0.268 . . . . 0.0 111.406 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.92 HG13 HD11 ' B' ' 26' ' ' LEU . 41.1 t -62.42 -42.23 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 177.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.704 ' HG3' HG21 ' B' ' 55' ' ' ILE . 1.1 tmmt? -59.43 -56.97 15.26 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.436 177.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.92 -52.99 58.83 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.148 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.777 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.9 tp -61.19 -42.77 99.17 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.038 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.418 HD12 HG12 ' B' ' 92' ' ' VAL . 21.2 mt -68.01 -43.89 77.8 Favored 'General case' 0 C--O 1.218 -0.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.18 -24.1 66.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.066 0.936 . . . . 0.0 109.381 178.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -84.9 -49.98 7.91 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.326 -1.306 . . . . 0.0 110.74 178.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.777 HD12 ' HG ' ' B' ' 95' ' ' LEU . 11.9 mt -77.09 -47.28 20.92 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 113.574 -1.648 . . . . 0.0 115.257 -176.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.718 HD23 ' HB3' ' B' ' 47' ' ' TYR . 33.0 mt -50.19 -54.8 30.04 Favored Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -176.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' B' ' 100' ' ' LEU . 25.9 Cg_endo -60.64 -16.49 43.44 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 122.091 1.861 . . . . 0.0 113.337 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -87.77 -8.73 55.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -119.28 -35.44 3.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.269 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' B' ' 100' ' ' LEU . 62.1 pttt -80.93 114.87 20.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.383 0.611 . . . . 0.0 109.974 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.481 ' HA ' ' HD2' ' B' ' 105' ' ' ARG . 8.9 tpt85 -142.43 93.75 2.57 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.479 ' CE ' ' HA ' ' A' ' 410' ' ' ASP . 3.0 pptp? -92.4 -166.62 1.58 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.244 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -78.95 50.07 0.99 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 14.4 t30 . . . . . 0 C--O 1.243 0.753 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.335 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 7.2 p90 . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.12 135.29 27.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 85.37 -68.05 3.51 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.568 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . 0.533 ' HG2' ' CG ' ' B' ' 76' ' ' ASN . 9.8 tp10 -119.49 127.99 53.56 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.231 0.539 . . . . 0.0 110.853 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -136.65 30.62 2.84 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.241 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.749 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 22.9 t70 -50.77 -37.51 42.57 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.06 -178.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.724 ' HB2' ' O ' ' A' ' 397' ' ' ASP . 7.4 tt0 165.9 -95.95 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 177.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.975 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 54.3 tt0 -114.09 95.73 5.45 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.304 -177.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.646 ' HB2' ' CD1' ' A' ' 403' ' ' PHE . 13.1 p-10 -136.59 93.21 2.84 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.753 0.787 . . . . 0.0 111.803 -178.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.521 ' C ' ' H ' ' A' ' 403' ' ' PHE . 24.2 p-10 -139.29 -44.72 0.46 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 16.2 p30 -74.41 12.8 0.69 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.718 0.77 . . . . 0.0 110.103 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.756 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -55.29 121.54 9.13 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.673 179.814 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -97.72 133.68 41.92 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.426 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.658 ' HG3' ' HB2' ' A' ' 409' ' ' ASP . 5.6 mm-40 -86.29 171.51 11.17 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.215 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -168.44 -23.91 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.747 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . 0.584 ' HB3' ' CB ' ' B' ' 52' ' ' CYS . 17.1 t0 -93.45 -7.07 45.52 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 83.92 121.88 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 113.293 -1.776 . . . . 0.0 113.626 175.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.658 ' HB2' ' HG3' ' A' ' 405' ' ' GLU . 9.4 t0 -99.71 49.27 0.93 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.006 -1.452 . . . . 0.0 111.289 -178.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.246 0.878 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.735 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.7 tpt . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.35 30.72 19.97 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.382 0.611 . . . . 0.0 110.079 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -111.51 -60.27 1.87 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.548 -179.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . 0.721 ' HB2' ' HG3' ' B' ' 29' ' ' GLU . 7.0 m -80.23 101.51 8.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.343 0.592 . . . . 0.0 110.151 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . 0.447 ' HB3' ' CZ ' ' B' ' 30' ' ' ARG . 70.5 m -151.89 27.05 0.63 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.516 -179.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.33 6.16 7.73 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.921 0.867 . . . . 0.0 109.851 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.468 ' HG2' ' N ' ' B' ' 8' ' ' VAL . 0.0 OUTLIER -123.26 149.39 44.82 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 114.347 -1.297 . . . . 0.0 109.513 -179.034 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.468 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 41.8 t -123.58 117.75 52.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.826 0.346 . . . . 0.0 110.289 179.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 82.4 mt -87.16 -31.93 20.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.711 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.422 ' CD2' HG22 ' B' ' 92' ' ' VAL . 5.9 tp -138.53 134.5 33.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.402 HG23 ' CE1' ' B' ' 25' ' ' TYR . 68.3 mt -117.61 124.18 72.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.753 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 5.2 t -115.65 149.96 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.652 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.643 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.1 OUTLIER -111.17 179.3 4.08 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.43 -178.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.542 ' H ' ' HD2' ' B' ' 14' ' ' LYS . 1.3 mptp? 18.55 70.63 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 O-C-N 124.978 1.424 . . . . 0.0 113.939 -179.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.668 ' HA ' ' O ' ' B' ' 78' ' ' HIS . 25.0 t -123.39 120.35 59.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.151 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.541 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 3.2 mtm180 -92.38 142.39 27.49 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.198 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.58 ' HG3' HG13 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -139.33 105.38 5.21 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.17 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 mptt 71.91 49.24 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.887 0.742 . . . . 0.0 110.818 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.749 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 7.9 mptt 70.6 27.66 3.72 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.658 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 4.8 pt20 -145.98 132.46 19.73 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.911 -0.493 . . . . 0.0 110.649 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -80.06 153.17 28.95 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.967 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.525 ' HA2' ' H ' ' B' ' 36' ' ' GLU . . . -178.09 -162.67 28.35 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.239 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.99 137.44 54.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.062 0.458 . . . . 0.0 109.863 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.917 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.3 tp -98.01 141.51 30.88 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.24 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . 0.402 ' CE1' HG23 ' B' ' 11' ' ' ILE . 34.5 m-85 -136.57 113.7 10.61 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.796 HD11 HG13 ' B' ' 92' ' ' VAL . 14.7 mt -90.53 130.99 36.52 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.34 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 15.0 mtt -112.13 159.89 18.09 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.03 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -44.3 -40.31 5.16 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.721 ' HG3' ' HB2' ' B' ' 4' ' ' SER . 20.7 mt-10 -119.53 -4.44 10.34 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.447 ' CZ ' ' HB3' ' B' ' 5' ' ' SER . 27.2 ptt180 -151.72 158.63 43.64 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.534 -177.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 1.016 HD13 HD11 ' B' ' 67' ' ' LEU . 1.7 tt -107.83 120.49 59.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 178.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -120.26 146.85 45.67 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.001 0.429 . . . . 0.0 110.694 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.917 ' HB2' HD12 ' B' ' 24' ' ' LEU . 24.1 t90 -146.83 140.07 25.48 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.574 ' HB2' ' HA ' ' B' ' 41' ' ' PHE . . . -133.93 141.05 38.3 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.798 -179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.507 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 14.3 Cg_exo -65.94 141.51 64.96 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.383 2.055 . . . . 0.0 110.522 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.525 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 4.4 mt-10 -64.57 116.0 5.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.318 0.58 . . . . 0.0 109.589 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 109.61 3.29 30.62 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.569 ' HA ' ' NZ ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -107.14 148.5 28.75 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.403 0.62 . . . . 0.0 111.306 179.467 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -93.32 -22.35 19.02 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.473 -1.24 . . . . 0.0 111.828 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.1 133.77 55.6 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.73 0.3 . . . . 0.0 111.174 -178.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.574 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 75.2 m-85 -68.66 120.98 15.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . 0.437 ' OG1' ' HD3' ' B' ' 35' ' ' PRO . 0.8 OUTLIER -79.91 -39.33 30.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.023 0.44 . . . . 0.0 110.638 -179.799 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.65 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 17.6 mm -93.08 119.12 40.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.954 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -147.95 101.22 3.28 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.472 ' CD2' HG23 ' B' ' 43' ' ' ILE . 52.3 m-70 -132.05 143.32 49.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.935 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.4 ' O ' HG12 ' B' ' 50' ' ' ILE . 5.9 mtp -91.36 145.16 24.87 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.742 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.0 m-85 -57.51 -21.69 39.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.045 0.45 . . . . 0.0 110.413 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.65 -10.7 59.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.992 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.593 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -108.01 -4.59 17.69 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.315 0.578 . . . . 0.0 109.831 179.624 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.702 ' HB ' HD22 ' B' ' 100' ' ' LEU . 2.7 mm -90.3 132.84 33.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.254 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.541 ' HE2' ' SG ' ' B' ' 52' ' ' CYS . 17.7 ttpt -88.86 -41.84 12.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.274 0.559 . . . . 0.0 109.713 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.734 ' SG ' ' HB ' ' B' ' 68' ' ' VAL . 24.3 p -162.35 -178.0 6.03 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.403 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -146.73 139.24 25.01 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.741 0.305 . . . . 0.0 110.853 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.049 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 19.0 mttp -109.58 156.5 20.1 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.545 HG21 ' HG3' ' B' ' 93' ' ' LYS . 0.8 OUTLIER -130.37 128.09 63.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 176.048 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.7 p -89.03 118.92 69.68 Favored Pre-proline 0 C--O 1.249 1.036 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.32 173.18 13.49 Favored 'Trans proline' 0 C--O 1.234 0.316 1 C-N-CA 125.311 4.008 . . . . 0.0 114.559 -177.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -60.21 160.98 7.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.201 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.31 -29.14 7.82 Favored Glycine 0 C--N 1.316 -0.53 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.975 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 10.0 mttp -90.7 154.0 19.87 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 2.76 8.49 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.236 0.541 . . . . 0.0 110.502 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.23 148.04 32.08 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.526 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.636 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.2 mp -96.86 136.54 27.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.405 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 10.5 mt-30 -138.7 163.24 32.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -177.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.585 ' HB2' ' HE2' ' B' ' 79' ' ' PHE . 1.7 tp -139.6 153.59 47.4 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 113.812 -1.54 . . . . 0.0 106.862 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.049 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.5 OUTLIER -145.99 134.49 22.03 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 119.302 0.955 . . . . 0.0 111.266 178.845 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 1.016 HD11 HD13 ' B' ' 31' ' ' ILE . 26.0 mt -94.15 104.15 16.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.768 178.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.734 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 4.0 t -88.62 103.73 14.1 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.592 HD22 HD13 ' B' ' 50' ' ' ILE . 2.4 mt -89.25 157.86 18.07 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.05 -177.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.593 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.4 OUTLIER -81.3 0.27 37.77 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.018 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.79 -10.16 59.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.409 179.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 96.15 11.57 54.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.002 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -126.41 154.72 43.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.563 HG22 ' HA ' ' B' ' 68' ' ' VAL . 13.7 p -124.11 131.01 53.5 Favored 'General case' 0 N--CA 1.442 -0.825 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.584 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 1.4 m -103.64 98.63 8.48 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.535 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 4.8 m-20 -85.74 122.36 29.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.404 0.621 . . . . 0.0 111.885 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.632 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 63.0 m-85 -103.81 113.37 26.85 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.008 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.668 ' O ' ' HA ' ' B' ' 15' ' ' VAL . 1.9 t60 -86.59 100.0 12.11 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.041 -178.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.684 ' CE1' HG11 ' B' ' 12' ' ' VAL . 54.8 m-85 -76.84 88.18 3.44 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.09 13.09 35.69 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.536 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 1.8 t-20 -83.22 92.94 7.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.318 0.58 . . . . 0.0 109.933 179.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.06 -34.9 0.79 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.84 -59.57 3.42 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -178.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.514 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 20.5 p -127.36 11.6 6.92 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -176.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -44.9 -47.87 11.24 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.96 -52.1 65.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.887 0.375 . . . . 0.0 110.817 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.514 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 4.8 mttt -66.6 -34.11 77.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.922 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.63 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.1 mt-10 -65.71 -44.44 86.08 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.636 ' HD3' HG23 ' B' ' 63' ' ' ILE . 26.2 ttp180 -56.29 -47.86 77.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . 0.545 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.9 OUTLIER -62.43 -44.38 96.55 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 113.865 -1.516 . . . . 0.0 112.381 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.14 -44.46 79.77 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.767 0.258 . . . . 0.0 111.312 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.796 HG13 HD11 ' B' ' 26' ' ' LEU . 48.9 t -60.33 -44.09 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.545 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 1.1 tmmt? -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.724 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -55.53 25.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.895 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.683 ' HG ' HD12 ' B' ' 99' ' ' LEU . 12.4 tp -63.26 -32.56 74.01 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.139 -179.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.515 HD12 HG12 ' B' ' 92' ' ' VAL . 20.9 mt -76.36 -39.26 54.32 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -66.08 -18.58 65.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.289 1.042 . . . . 0.0 108.621 178.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -87.88 -48.4 7.84 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.521 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.683 HD12 ' HG ' ' B' ' 95' ' ' LEU . 16.3 mt -82.8 -37.32 24.68 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 -176.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.742 HD23 ' HB3' ' B' ' 47' ' ' TYR . 66.4 mt -63.48 -58.44 15.48 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.689 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 37.7 Cg_exo -58.57 -23.49 65.23 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.245 1.964 . . . . 0.0 113.499 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.526 ' HG2' ' HA ' ' B' ' 99' ' ' LEU . 2.3 ptmm? -88.15 1.37 54.52 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.467 ' HD1' ' O ' ' B' ' 99' ' ' LEU . 21.6 m-85 -124.26 -35.66 2.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.705 0.288 . . . . 0.0 111.132 179.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -81.8 161.09 23.37 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' B' ' 108' ' ' ASN . 0.3 OUTLIER -62.75 -50.98 68.93 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . 0.787 ' HA ' ' HE3' ' B' ' 106' ' ' LYS . 0.1 OUTLIER 179.92 -68.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.59 178.739 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -120.62 13.29 11.64 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.978 0.894 . . . . 0.0 108.812 178.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.451 ' O ' ' HB2' ' B' ' 105' ' ' ARG . 4.7 p-10 . . . . . 0 C--O 1.253 1.288 0 CA-C-N 113.912 -1.495 . . . . 0.0 108.212 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . . . . . . . . . 22.5 p90 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . . . . . . . . . 42.4 t -64.64 112.65 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 179.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 101.53 -80.81 0.42 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -99.11 131.66 44.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.144 0.497 . . . . 0.0 109.776 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . 0.514 ' C ' ' H ' ' A' ' 398' ' ' GLU . 4.2 t70 -136.67 31.0 2.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.797 -179.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 398' ' ' GLU . 0.4 OUTLIER -64.51 16.61 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -178.837 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.514 ' H ' ' C ' ' A' ' 396' ' ' ASP . 8.4 tt0 108.15 -68.9 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.655 1.582 . . . . 0.0 113.186 175.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.945 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 62.7 tt0 -148.72 93.09 2.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.92 0.39 . . . . 0.0 110.916 -177.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.611 ' HB2' ' CE2' ' A' ' 403' ' ' PHE . 11.8 p-10 -134.0 94.46 3.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.76 0.79 . . . . 0.0 111.857 -178.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.496 ' C ' ' H ' ' A' ' 403' ' ' PHE . 25.3 p-10 -139.42 -46.98 0.46 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -73.31 12.09 0.64 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.377 0.608 . . . . 0.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 0.674 ' HB3' ' CD ' ' B' ' 54' ' ' LYS . 0.2 OUTLIER -53.29 115.96 2.17 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.596 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.73 136.62 37.46 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 1.036 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -148.98 -178.52 6.41 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.576 1.324 . . . . 0.0 114.576 -176.733 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . 0.427 ' C ' ' H ' ' A' ' 408' ' ' GLU . 24.7 p-10 -154.77 62.4 0.66 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 111.977 -2.374 . . . . 0.0 105.183 177.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . 0.574 ' HA ' ' SG ' ' B' ' 52' ' ' CYS . 0.1 OUTLIER -59.21 14.11 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -176.429 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . 0.492 ' H ' ' HG3' ' A' ' 408' ' ' GLU . 1.6 mt-10 -63.27 -76.09 0.07 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -175.78 72.61 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.862 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.751 ' HB3' ' HA ' ' B' ' 52' ' ' CYS . 16.1 t70 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.057 -179.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.481 1.091 0 CA-C-O 120.67 0.271 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.02 100.07 2.0 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.4 44.61 7.13 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.708 0.766 . . . . 0.0 109.854 -179.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.29 15.1 23.85 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.795 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . 0.454 ' HA ' ' CD ' ' B' ' 29' ' ' GLU . 16.2 m 67.76 19.49 9.64 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.301 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.552 ' OE2' ' HA ' ' B' ' 6' ' ' GLU . 2.7 mm-40 -146.52 19.87 1.34 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.598 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.647 ' O ' ' HA ' ' B' ' 27' ' ' MET . 0.4 OUTLIER -81.76 101.11 9.91 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.472 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 90.9 t -81.82 117.45 27.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.371 0.605 . . . . 0.0 111.477 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.508 ' HB2' HD21 ' B' ' 95' ' ' LEU . 23.4 mt -97.79 -31.61 12.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.34 179.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 6.3 tp -132.97 137.8 46.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.8 mt -122.34 121.59 64.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.737 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 3.5 t -110.6 148.67 13.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.136 -179.373 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.559 ' HD3' ' N ' ' B' ' 13' ' ' LYS . 0.1 OUTLIER -108.3 174.09 6.03 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.673 -178.78 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 18.0 70.05 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 O-C-N 125.084 1.49 . . . . 0.0 114.27 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.558 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.1 t -116.21 120.98 66.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.612 ' HB2' ' HB3' ' B' ' 78' ' ' HIS . 31.9 mtp180 -96.7 119.85 35.93 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.154 0.502 . . . . 0.0 110.953 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' B' ' 76' ' ' ASN . 10.7 tm0? -109.98 119.84 40.58 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.601 ' HA ' ' HE3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER 65.56 33.52 8.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -178.262 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.35 18.65 7.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.332 -1.304 . . . . 0.0 111.552 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.586 ' O ' ' HA ' ' B' ' 16' ' ' ARG . 6.1 tp-100 -110.12 119.1 38.21 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.33 144.4 56.59 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.741 ' HA2' ' HG3' ' B' ' 36' ' ' GLU . . . -178.92 -165.94 34.12 Favored Glycine 0 C--N 1.332 0.357 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.409 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.59 136.81 53.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.071 0.462 . . . . 0.0 109.897 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.948 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -97.81 142.22 29.84 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.4 -177.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -135.03 124.16 24.38 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.845 HD11 HG13 ' B' ' 92' ' ' VAL . 19.3 mt -105.3 121.11 43.19 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.643 -178.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.647 ' HA ' ' O ' ' B' ' 7' ' ' GLU . 2.3 mpt? -97.88 159.13 15.13 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.79 -21.54 56.27 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.454 ' CD ' ' HA ' ' B' ' 5' ' ' SER . 3.9 mp0 -116.87 -16.85 10.55 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.503 HH21 ' CD ' ' B' ' 6' ' ' GLU . 12.8 ptt180 -154.84 164.73 38.4 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.374 -176.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 1.005 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -114.32 122.55 68.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.233 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -125.45 152.55 44.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.033 0.444 . . . . 0.0 110.512 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.948 ' HB2' HD12 ' B' ' 24' ' ' LEU . 21.9 t90 -146.87 136.81 23.3 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.453 ' HA ' ' HD3' ' B' ' 35' ' ' PRO . . . -122.38 135.35 25.46 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.185 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 1.081 ' HB2' ' HD3' ' B' ' 38' ' ' LYS . 4.8 Cg_exo -72.08 150.09 53.57 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.54 2.16 . . . . 0.0 111.803 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.741 ' HG3' ' HA2' ' B' ' 22' ' ' GLY . 35.1 mt-10 -63.66 124.41 21.36 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.928 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.59 6.47 62.43 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.521 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 1.081 ' HD3' ' HB2' ' B' ' 35' ' ' PRO . 10.0 mptt -113.32 149.71 33.57 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -97.06 -1.39 45.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.888 -178.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -132.63 151.07 52.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.169 0.509 . . . . 0.0 112.055 -178.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.422 ' CD1' ' HB2' ' B' ' 34' ' ' ALA . 44.1 m-85 -83.88 121.26 27.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.678 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.1 p -87.53 -21.85 25.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.208 0.528 . . . . 0.0 110.487 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.608 ' HB ' ' HB3' ' B' ' 33' ' ' TRP . 11.5 mm -102.39 122.98 55.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.23 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.3 t -147.68 101.56 3.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.183 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.503 ' CD2' HG23 ' B' ' 43' ' ' ILE . 51.0 m-70 -133.99 139.44 46.06 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.473 ' O ' HG12 ' B' ' 50' ' ' ILE . 44.4 mtp -96.94 148.68 22.71 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.659 ' HB3' HD23 ' B' ' 100' ' ' LEU . 21.4 m-85 -58.18 -23.2 54.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.853 0.359 . . . . 0.0 111.287 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.99 -25.28 62.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.053 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.599 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -97.15 -4.76 38.66 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.823 0.344 . . . . 0.0 110.833 -179.614 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.564 HD13 HD22 ' B' ' 69' ' ' LEU . 4.1 mm -83.45 131.48 33.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.458 ' H ' ' HA ' ' B' ' 69' ' ' LEU . 13.7 tttm -91.94 -37.19 13.01 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.73 0.3 . . . . 0.0 110.352 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.751 ' HA ' ' HB3' ' A' ' 410' ' ' ASP . 1.6 p -169.39 179.97 3.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -139.83 143.83 37.0 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.616 -0.434 . . . . 0.0 111.271 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.125 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 16.9 mttm -115.3 150.1 36.78 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 176.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.526 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.7 OUTLIER -130.57 129.25 64.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.653 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.471 ' HB3' ' HB2' ' B' ' 64' ' ' GLN . 2.5 p -91.34 121.15 67.99 Favored Pre-proline 0 C--O 1.249 1.028 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.283 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -72.56 173.44 13.27 Favored 'Trans proline' 0 C--O 1.234 0.318 1 C-N-CA 125.586 4.191 . . . . 0.0 114.733 -177.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -58.67 160.64 5.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.407 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.92 -29.01 8.03 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 -178.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.945 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 9.9 mttp -89.81 154.62 19.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.3 -11.85 61.18 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.216 0.532 . . . . 0.0 110.299 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.659 ' HE2' ' HB3' ' A' ' 399' ' ' GLU . 0.0 OUTLIER -138.15 140.84 40.04 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.769 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.57 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.3 mp -85.21 140.3 16.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.471 ' HB2' ' HB3' ' B' ' 56' ' ' SER . 18.8 mt-30 -139.94 163.18 33.35 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -177.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.473 ' HB2' ' HE1' ' B' ' 79' ' ' PHE . 1.3 tp -142.54 153.54 43.67 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.339 176.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.125 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 137.22 23.73 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 119.241 0.928 . . . . 0.0 110.939 178.281 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 1.005 HD11 HD13 ' B' ' 31' ' ' ILE . 96.4 mt -94.14 104.09 16.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.869 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.588 ' HB ' ' SG ' ' B' ' 52' ' ' CYS . 5.7 t -88.59 110.78 21.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.564 HD22 HD13 ' B' ' 50' ' ' ILE . 4.4 mt -97.57 155.9 16.76 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -177.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.6 OUTLIER -81.67 2.95 27.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.013 178.218 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.85 -5.83 59.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.157 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.31 16.14 53.94 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.547 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -126.12 154.3 43.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.759 0.314 . . . . 0.0 110.775 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.549 HG22 ' HA ' ' B' ' 68' ' ' VAL . 17.0 p -130.23 130.71 44.95 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.59 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 3.2 m -106.56 98.98 8.58 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.62 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.494 ' OD1' ' HB2' ' B' ' 66' ' ' GLN . 5.3 m-20 -82.41 147.09 28.97 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.005 0.431 . . . . 0.0 110.848 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.51 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 59.2 m-85 -131.24 112.71 13.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.834 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.612 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.7 t-160 -87.03 99.91 12.24 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.285 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.692 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 43.1 m-85 -75.07 100.02 4.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.53 11.4 28.76 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -85.66 91.66 8.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.243 0.544 . . . . 0.0 109.733 179.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.58 -34.23 2.07 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.23 -57.66 7.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -178.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.511 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.8 p -127.48 8.72 6.5 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -176.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.692 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -43.93 -47.27 8.43 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -178.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 2.6 t -59.84 -54.18 38.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.915 0.388 . . . . 0.0 110.747 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.9 mttt -65.55 -33.36 75.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.959 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.674 ' O ' HG23 ' B' ' 92' ' ' VAL . 12.7 mt-10 -66.09 -45.39 81.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.57 ' HD3' HG23 ' B' ' 63' ' ' ILE . 17.6 ttp180 -56.06 -47.91 77.04 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . 0.725 ' HA ' ' HE3' ' B' ' 93' ' ' LYS . 0.7 OUTLIER -61.22 -44.19 97.67 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 113.619 -1.628 . . . . 0.0 111.96 179.797 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.61 84.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.704 0.229 . . . . 0.0 111.08 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.845 HG13 HD11 ' B' ' 26' ' ' LEU . 45.4 t -62.81 -44.69 99.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.725 ' HE3' ' HA ' ' B' ' 90' ' ' ASP . 0.8 OUTLIER -58.82 -52.68 64.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.793 178.254 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . 0.457 ' HA ' ' HG2' ' B' ' 97' ' ' GLN . 1.2 m-20 -58.67 -53.29 59.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.81 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.718 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.2 tp -60.64 -38.58 85.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.401 HD12 HG12 ' B' ' 92' ' ' VAL . 25.8 mt -70.15 -45.44 66.76 Favored 'General case' 0 C--O 1.212 -0.89 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 178.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.457 ' HG2' ' HA ' ' B' ' 94' ' ' ASP . 19.7 pt20 -64.85 -18.07 64.83 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.218 1.009 . . . . 0.0 109.195 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -85.91 -49.78 7.61 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.289 -1.323 . . . . 0.0 109.928 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.718 HD12 ' HG ' ' B' ' 95' ' ' LEU . 17.9 mt -78.96 -47.25 16.68 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.473 -1.694 . . . . 0.0 115.146 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.659 HD23 ' HB3' ' B' ' 47' ' ' TYR . 34.9 mt -52.23 -56.3 23.43 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 32.2 Cg_exo -61.59 -13.43 29.72 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.398 2.065 . . . . 0.0 113.417 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 7.9 mtmm -85.48 -23.17 27.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.982 0.42 . . . . 0.0 110.285 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -120.08 21.11 11.94 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.657 ' HA ' ' HE3' ' B' ' 104' ' ' LYS . 0.4 OUTLIER -57.95 101.15 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.019 -0.991 . . . . 0.0 112.285 -178.277 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -146.07 -144.81 0.16 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.231 -0.895 . . . . 0.0 108.869 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 29.4 mmtm -144.13 97.51 3.06 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . 73.84 -175.33 0.15 Allowed 'General case' 0 C--O 1.235 0.33 0 O-C-N 124.409 1.068 . . . . 0.0 110.999 -179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.605 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 392' ' ' TYR . . . . . 0.868 ' HE2' ' HA ' ' A' ' 399' ' ' GLU . 7.5 p90 . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 393' ' ' VAL . . . . . 0.406 ' H ' ' HB2' ' A' ' 392' ' ' TYR . 24.7 t -61.74 119.75 6.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.646 0.26 . . . . 0.0 110.488 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 394' ' ' GLY . . . . . . . . . . . . . . . 96.03 -82.22 0.8 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.785 -0.721 . . . . 0.0 111.62 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -108.65 144.1 36.85 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 396' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -129.71 30.08 4.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.485 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.562 ' O ' ' HD2' ' B' ' 19' ' ' LYS . 1.7 t70 -66.81 -31.88 72.8 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 398' ' ' GLU . . . . . 0.588 ' HB3' ' HE3' ' B' ' 62' ' ' LYS . 1.1 tm-20 167.53 -60.86 0.01 OUTLIER 'General case' 0 C--O 1.232 0.134 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.074 177.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 399' ' ' GLU . . . . . 0.869 ' HG2' ' HE3' ' B' ' 60' ' ' LYS . 63.0 tt0 -168.62 100.51 0.4 Allowed 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 400' ' ' ASP . . . . . 0.631 ' HB3' ' CD1' ' A' ' 403' ' ' PHE . 0.8 OUTLIER -133.67 90.74 2.75 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -175.513 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 401' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 403' ' ' PHE . 0.7 OUTLIER -138.99 -48.41 0.5 Allowed 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 402' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -72.06 13.59 0.29 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.929 0.871 . . . . 0.0 110.538 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 403' ' ' PHE . . . . . 1.004 ' HB3' ' HD3' ' B' ' 54' ' ' LYS . 0.1 OUTLIER -61.68 119.39 8.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.192 -1.367 . . . . 0.0 111.025 179.553 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 404' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -108.53 133.34 52.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.775 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 405' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' B' ' 54' ' ' LYS . 1.8 pt-20 -114.85 -112.94 0.34 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.514 0.197 . . . . 0.0 110.91 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 406' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.06 -172.32 3.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.938 0.399 . . . . 0.0 110.911 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 407' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -112.12 -2.96 14.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.591 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.07 163.14 19.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.106 0.479 . . . . 0.0 111.826 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 409' ' ' ASP . . . . . 0.471 ' CG ' HH12 ' B' ' 105' ' ' ARG . 29.5 p-10 -95.16 -42.88 8.35 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 410' ' ' ASP . . . . . 0.678 ' HA ' ' NZ ' ' B' ' 104' ' ' LYS . 7.5 t70 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.112 -0.947 . . . . 0.0 111.423 177.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 43.6 ttm . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.69 23.92 0.18 Allowed 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 6.2 m 63.63 61.91 0.97 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.388 0.613 . . . . 0.0 111.526 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.01 -50.16 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.981 179.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 63.0 m -156.91 78.89 0.91 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.849 ' HB2' ' HB3' ' B' ' 27' ' ' MET . 2.2 mm-40 -78.18 161.33 27.42 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.18 -176.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.425 ' O ' ' HA ' ' B' ' 27' ' ' MET . 1.9 mp0 -63.9 111.28 2.41 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.378 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.42 HG11 HG12 ' B' ' 11' ' ' ILE . 63.9 t -82.48 104.24 10.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 23.7 mt -82.78 -31.11 28.42 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.515 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 7.6 tp -132.53 123.03 25.74 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.42 HG12 HG11 ' B' ' 8' ' ' VAL . 73.1 mt -109.6 120.64 61.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 177.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.758 ' HB ' ' HB3' ' B' ' 24' ' ' LEU . 6.0 t -112.91 149.62 15.32 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.61 ' O ' HG23 ' B' ' 15' ' ' VAL . 0.0 OUTLIER -109.48 -179.94 3.97 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.984 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.429 ' HB2' ' HB2' ' B' ' 81' ' ' ASN . 7.8 mttp 17.95 76.31 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 125.393 1.683 . . . . 0.0 113.533 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.61 HG23 ' O ' ' B' ' 13' ' ' LYS . 39.6 t -127.9 125.0 64.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.596 ' HA ' ' O ' ' B' ' 20' ' ' GLN . 1.4 mtt-85 -99.04 146.11 26.39 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.388 0.614 . . . . 0.0 112.201 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . 0.536 ' O ' ' HG2' ' B' ' 20' ' ' GLN . 6.4 tp-100 -119.75 102.71 8.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.445 -1.316 . . . . 0.0 107.445 176.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' B' ' 19' ' ' LYS . 1.1 mptp? 55.61 56.73 5.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.104 -178.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.562 ' HD2' ' O ' ' A' ' 397' ' ' ASP . 3.2 mptm? 76.33 9.75 3.1 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 178.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' GLN . . . . . 0.691 ' HG3' ' HH2' ' B' ' 33' ' ' TRP . 5.9 pt20 -119.56 119.65 34.41 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.173 0.897 . . . . 0.0 110.755 178.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.538 ' OD2' ' HD3' ' B' ' 16' ' ' ARG . 2.1 m-20 -72.42 149.68 44.04 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.639 ' HA3' ' HA ' ' B' ' 35' ' ' PRO . . . -175.98 -161.31 24.97 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.744 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.36 139.45 53.66 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.884 HD12 ' HB2' ' B' ' 33' ' ' TRP . 6.0 tp -100.75 137.28 39.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.743 -178.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -133.46 108.72 8.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.826 0.346 . . . . 0.0 110.412 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.954 HD11 HG13 ' B' ' 92' ' ' VAL . 10.7 mt -84.59 121.42 27.6 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.905 0.383 . . . . 0.0 110.332 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . 0.849 ' HB3' ' HB2' ' B' ' 6' ' ' GLU . 0.5 OUTLIER -99.38 166.32 11.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.486 -178.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -45.2 -52.99 8.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.454 ' CD ' HH21 ' B' ' 30' ' ' ARG . 1.5 mp0 -114.2 7.03 16.46 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.502 ' NE ' ' HG3' ' B' ' 6' ' ' GLU . 10.1 ptp180 -158.94 157.86 32.2 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.513 -0.875 . . . . 0.0 112.682 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' ILE . . . . . 0.966 HD13 HD11 ' B' ' 67' ' ' LEU . 0.7 OUTLIER -103.68 119.03 51.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.345 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.529 ' HA ' ' O ' ' B' ' 43' ' ' ILE . . . -115.31 147.07 40.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.911 0.386 . . . . 0.0 110.801 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' TRP . . . . . 0.884 ' HB2' HD12 ' B' ' 24' ' ' LEU . 35.9 t90 -147.18 145.46 29.51 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 1.064 ' HB1' ' HG3' ' B' ' 38' ' ' LYS . . . -145.44 133.23 10.45 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.746 -0.206 . . . . 0.0 111.183 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.639 ' HA ' ' HA3' ' B' ' 22' ' ' GLY . 69.7 Cg_endo -70.68 132.77 22.48 Favored 'Trans proline' 0 N--CA 1.476 0.474 0 C-N-CA 123.457 2.771 . . . . 0.0 111.79 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.546 ' H ' ' HA2' ' B' ' 22' ' ' GLY . 0.0 OUTLIER -50.3 132.17 24.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.194 -178.453 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.73 11.03 39.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -177.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 1.064 ' HG3' ' HB1' ' B' ' 34' ' ' ALA . 0.0 OUTLIER -99.62 166.7 11.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.585 -0.807 . . . . 0.0 111.953 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -124.22 -4.98 7.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.444 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -146.2 164.09 33.35 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.259 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.66 ' HA ' ' HB2' ' B' ' 34' ' ' ALA . 36.2 m-85 -88.22 130.86 34.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.229 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 1.3 p -94.33 -25.92 16.79 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.56 . . . . 0.0 110.32 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.768 HG21 ' HZ ' ' B' ' 77' ' ' PHE . 23.7 mm -106.04 120.68 57.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.302 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 45.8 t -147.91 101.43 3.3 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' HIS . . . . . 0.422 ' CD2' HG23 ' B' ' 43' ' ' ILE . 79.9 m-70 -123.33 137.96 54.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' MET . . . . . 0.472 ' O ' HG12 ' B' ' 50' ' ' ILE . 70.9 mmm -85.9 140.91 29.96 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.709 ' HB3' HD23 ' B' ' 100' ' ' LEU . 22.9 m-85 -57.66 -22.85 48.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.969 0.414 . . . . 0.0 110.501 179.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.77 -22.31 60.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.807 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.617 ' HA ' ' NE2' ' B' ' 70' ' ' HIS . 0.4 OUTLIER -96.32 -6.82 36.87 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.11 0.481 . . . . 0.0 110.067 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.64 ' HB ' HD22 ' B' ' 100' ' ' LEU . 4.4 mm -87.28 118.22 32.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.618 ' HD3' ' SG ' ' B' ' 52' ' ' CYS . 0.6 OUTLIER -79.39 -30.88 42.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.226 0.536 . . . . 0.0 109.615 -178.655 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.618 ' SG ' ' HD3' ' B' ' 51' ' ' LYS . 9.4 p -176.1 173.69 2.17 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.751 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' GLN . . . . . . . . . . . . . 18.8 pm0 -132.42 137.91 47.46 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.199 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 1.137 ' HB2' ' HG2' ' B' ' 66' ' ' GLN . 57.1 mttp -104.75 148.97 26.02 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.517 ' O ' HG13 ' B' ' 55' ' ' ILE . 0.8 OUTLIER -127.25 127.04 68.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 175.998 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.8 p -88.3 116.66 66.88 Favored Pre-proline 0 C--O 1.252 1.188 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.83 173.3 11.23 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 125.211 3.941 . . . . 0.0 114.484 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -60.73 160.33 9.54 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 113.47 -29.06 8.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 109.331 -1.507 . . . . 0.0 109.331 -177.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.869 ' HE3' ' HG2' ' A' ' 399' ' ' GLU . 11.5 mttp -88.45 152.26 22.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 176.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.4 -8.98 51.42 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 121.127 0.489 . . . . 0.0 110.942 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.588 ' HE3' ' HB3' ' A' ' 398' ' ' GLU . 0.0 OUTLIER -141.74 140.8 33.2 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.597 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' ILE . . . . . 0.594 HG23 ' HD3' ' B' ' 89' ' ' ARG . 3.4 mp -86.31 135.49 24.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 178.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -139.5 163.31 32.88 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 118.897 -1.121 . . . . 0.0 113.992 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 1.7 tp -138.88 153.07 48.26 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.054 -1.43 . . . . 0.0 107.522 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 1.137 ' HG2' ' HB2' ' B' ' 54' ' ' LYS . 0.6 OUTLIER -146.77 142.96 28.3 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 119.25 0.932 . . . . 0.0 111.183 178.201 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.966 HD11 HD13 ' B' ' 31' ' ' ILE . 95.7 mt -95.29 103.13 14.98 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.925 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.743 ' HA ' HG22 ' B' ' 74' ' ' THR . 12.3 t -87.12 115.94 28.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.534 HD22 HD13 ' B' ' 50' ' ' ILE . 4.1 mt -101.13 154.87 18.36 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.11 0.481 . . . . 0.0 111.952 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.617 ' NE2' ' HA ' ' B' ' 49' ' ' ASP . 0.1 OUTLIER -78.43 -1.95 36.05 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.384 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.99 -15.3 61.1 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.63 178.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 102.8 7.45 44.61 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.929 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.488 ' OD2' HD12 ' B' ' 69' ' ' LEU . 4.8 p-10 -126.44 167.71 15.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.117 0.484 . . . . 0.0 111.572 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . 0.743 HG22 ' HA ' ' B' ' 68' ' ' VAL . 33.2 p -136.63 131.45 33.7 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.752 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 67' ' ' LEU . 5.2 m -100.57 99.33 9.89 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 178.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' ASN . . . . . 0.44 HD22 ' CG ' ' A' ' 400' ' ' ASP . 2.5 m-20 -82.46 148.17 28.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.238 0.542 . . . . 0.0 111.485 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' PHE . . . . . 0.768 ' HZ ' HG21 ' B' ' 43' ' ' ILE . 54.0 m-85 -131.59 113.99 14.3 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.767 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.563 ' HB3' ' HB2' ' B' ' 16' ' ' ARG . 2.8 t-160 -87.05 105.3 17.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.447 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.751 ' HB3' ' HB1' ' B' ' 85' ' ' ALA . 29.0 m-85 -76.41 97.48 4.29 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.401 ' HB3' ' CZ ' ' B' ' 16' ' ' ARG . 0.6 OUTLIER -95.18 7.27 46.67 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . 0.429 ' HB2' ' HB2' ' B' ' 14' ' ' LYS . 54.7 t30 -81.35 91.19 6.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.128 0.49 . . . . 0.0 110.451 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.66 -24.97 9.52 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -59.98 2.46 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' THR . . . . . 0.525 ' HA ' ' HD2' ' B' ' 87' ' ' LYS . 22.7 p -127.82 13.46 6.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -176.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.751 ' HB1' ' HB3' ' B' ' 79' ' ' PHE . . . -46.15 -44.36 15.79 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.447 ' CG2' HG12 ' B' ' 63' ' ' ILE . 2.4 t -60.6 -53.52 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.027 0.442 . . . . 0.0 110.488 179.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.525 ' HD2' ' HA ' ' B' ' 84' ' ' THR . 5.4 mttt -66.48 -34.91 78.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.264 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.672 ' O ' HG23 ' B' ' 92' ' ' VAL . 13.5 mt-10 -67.5 -44.22 78.99 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . 0.594 ' HD3' HG23 ' B' ' 63' ' ' ILE . 22.5 ttp180 -55.42 -47.08 76.52 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.133 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -42.28 99.27 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.57 -1.65 . . . . 0.0 112.466 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.47 -43.65 76.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.72 0.236 . . . . 0.0 111.078 179.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.954 HG13 HD11 ' B' ' 26' ' ' LEU . 35.2 t -60.28 -44.45 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 177.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' B' ' 97' ' ' GLN . 0.5 OUTLIER -58.18 -54.87 42.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.089 178.337 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . 0.602 ' HA ' ' NE2' ' B' ' 97' ' ' GLN . 4.2 m-20 -56.73 -53.95 51.88 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.195 -179.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.646 ' HG ' HD12 ' B' ' 99' ' ' LEU . 13.5 tp -61.56 -32.67 72.76 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.472 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.63 -41.12 65.86 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.602 ' NE2' ' HA ' ' B' ' 94' ' ' ASP . 7.4 mt-30 -63.08 -22.67 67.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 122.149 0.976 . . . . 0.0 108.684 178.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -86.63 -47.42 9.2 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.793 -1.549 . . . . 0.0 111.439 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.646 HD12 ' HG ' ' B' ' 95' ' ' LEU . 14.7 mt -80.05 -47.76 14.35 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.124 -1.398 . . . . 0.0 114.757 -176.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.896 ' HB3' ' HD2' ' B' ' 104' ' ' LYS . 59.2 mt -52.55 -56.97 17.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -176.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.652 ' HD3' ' HB2' ' B' ' 100' ' ' LEU . 50.1 Cg_exo -56.83 -13.19 10.74 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 122.711 2.274 . . . . 0.0 113.875 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mtmm -87.15 -9.5 55.09 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 122.368 -0.208 . . . . 0.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -123.94 -20.86 5.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.496 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.896 ' HD2' ' HB3' ' B' ' 100' ' ' LEU . 5.7 mtpm? -75.25 -178.99 4.19 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.925 0.393 . . . . 0.0 110.902 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.471 HH12 ' CG ' ' A' ' 409' ' ' ASP . 0.3 OUTLIER -55.7 145.87 22.69 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.462 178.584 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.51 75.27 10.29 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -178.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -123.08 15.39 9.9 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 176.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 1.7 p30 . . . . . 0 C--N 1.32 -0.696 0 CA-C-N 112.805 -1.998 . . . . 0.0 107.932 -178.611 . . . . . . . . 0 0 . 1 stop_ save_