data_2mfa_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 2mfa _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.553 HD11 ' SG ' ' A' ' 19' ' ' CYS . 25.2 mt . . . . . 0 CA--C 1.489 -1.396 0 CA-C-O 121.454 0.645 . . . . 0.0 112.248 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -110.15 117.81 34.69 Favored 'General case' 0 N--CA 1.414 -2.263 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 171.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.56 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 95.5 m -138.51 164.51 29.23 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 120.777 0.322 . . . . 0.0 111.104 -176.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -80.88 75.0 7.84 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.388 0.613 . . . . 0.0 110.742 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -80.27 -40.67 26.46 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.256 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -106.28 20.03 19.6 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-O 121.476 0.655 . . . . 0.0 109.875 -177.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.6 -39.16 3.03 Favored Glycine 0 CA--C 1.498 -1.013 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -91.3 150.33 21.35 Favored 'General case' 0 C--O 1.258 1.514 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 173.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.0 p -75.22 112.59 12.94 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.211 0 CA-C-O 121.611 0.72 . . . . 0.0 111.108 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -119.29 153.0 21.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.114 -175.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.4 m -78.75 116.17 18.92 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.427 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.4 m -80.09 158.26 26.47 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t-80 -65.76 162.87 17.8 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.249 0.477 . . . . 0.0 110.802 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -63.77 -12.25 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -79.54 -21.39 45.23 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.627 0.727 . . . . 0.0 109.365 177.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.2 mtt -86.28 101.43 13.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.85 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -93.67 -18.5 22.08 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.84 -177.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -131.85 150.84 52.03 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.693 -176.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.553 ' SG ' HD11 ' A' ' 1' ' ' LEU . 58.2 m -112.75 138.13 50.03 Favored 'General case' 0 C--N 1.276 -2.626 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 172.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -116.34 148.0 41.02 Favored 'General case' 0 C--N 1.297 -1.689 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.446 -175.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -124.57 101.93 7.37 Favored 'General case' 0 N--CA 1.413 -2.275 0 CA-C-N 113.904 -1.498 . . . . 0.0 106.977 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.455 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 47.3 t-20 -102.62 130.04 49.39 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 38.4 p -83.21 -11.37 57.91 Favored 'General case' 0 C--N 1.289 -2.041 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.45 -134.02 12.42 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.5 mmm -118.04 148.23 43.08 Favored Pre-proline 0 C--N 1.281 -2.396 0 N-CA-C 105.301 -2.111 . . . . 0.0 105.301 173.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -64.98 104.25 0.56 Allowed 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 120.94 1.093 . . . . 0.0 111.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -133.34 143.72 49.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.858 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 -99.29 149.8 22.76 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 66.1 t30 70.87 13.05 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.435 1.094 . . . . 0.0 110.451 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.5 tp -119.96 106.94 12.52 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.775 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -105.62 89.17 3.02 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.4 mt -122.04 130.02 52.92 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.7 mm -95.53 129.3 45.83 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 CA-C-O 121.455 0.645 . . . . 0.0 111.77 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.455 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 5.6 mp -120.17 68.91 0.85 Allowed 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.812 175.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -122.6 113.5 19.35 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.27 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.01 -159.28 8.01 Favored Glycine 0 C--N 1.285 -2.259 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 19' ' ' CYS . 85.8 m -125.92 148.88 49.1 Favored 'General case' 0 C--N 1.285 -2.201 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.3 t -133.6 148.59 51.59 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.199 0.523 . . . . 0.0 110.564 -174.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.0 t -81.43 -40.33 23.53 Favored 'General case' 0 N--CA 1.425 -1.705 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.148 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.1 p -139.98 96.78 3.12 Favored 'General case' 0 N--CA 1.426 -1.651 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 15.3 t -92.14 153.94 19.01 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.761 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.1 t -110.27 109.39 19.83 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -70.38 108.95 4.48 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.782 -177.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.2 p -127.12 -169.58 2.06 Favored 'General case' 0 C--N 1.288 -2.1 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -97.78 -15.6 20.23 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 174.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.91 -42.96 23.05 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.666 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.43 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 5.5 t30 -125.41 118.5 25.99 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.505 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -95.96 145.01 25.77 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 34.0 m -123.33 116.29 23.07 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.85 148.98 40.79 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.0 p -118.62 22.21 12.15 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.559 0.695 . . . . 0.0 111.279 -175.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.8 m -116.31 147.8 41.2 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -65.05 138.87 58.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.448 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 62.87 19.7 11.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.365 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.3 p -67.0 -35.59 80.28 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.56 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -87.22 56.05 3.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.803 1.287 . . . . 0.0 111.529 -176.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? . . . . . 0 C--N 1.301 -1.504 0 CA-C-N 114.232 -1.349 . . . . 0.0 110.417 -179.845 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 19.4 mt . . . . . 0 CA--C 1.487 -1.457 0 CA-C-O 121.286 0.565 . . . . 0.0 112.134 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -110.8 123.26 49.74 Favored 'General case' 0 N--CA 1.416 -2.129 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 170.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 m -133.33 162.0 32.99 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -176.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.476 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.3 m-85 -81.36 85.34 6.45 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -77.45 -43.16 33.34 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 120.952 0.406 . . . . 0.0 111.867 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -107.76 18.39 21.41 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.318 1.056 . . . . 0.0 109.203 174.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.79 -16.85 59.08 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -105.17 140.74 37.88 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.6 p -74.96 115.02 15.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 CA-C-O 122.007 0.908 . . . . 0.0 111.744 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.5 m -120.35 152.29 23.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.976 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.9 m -71.84 118.04 14.18 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.373 0.606 . . . . 0.0 109.564 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.3 m -79.31 157.13 27.77 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -68.17 161.41 27.1 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -64.55 -6.45 7.54 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -81.37 -31.39 33.36 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -72.02 101.96 2.85 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.806 -174.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -95.42 -17.08 21.82 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.904 -1.498 . . . . 0.0 109.88 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -135.02 148.0 49.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.4 m -98.06 137.99 36.04 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 170.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.514 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 52.5 p90 -116.34 142.84 46.32 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 118.474 -1.291 . . . . 0.0 111.767 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -115.34 122.57 46.28 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -112.81 126.21 55.19 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 29.6 p -92.88 79.99 4.66 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.696 0.76 . . . . 0.0 110.765 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.541 ' HA3' ' O ' ' A' ' 32' ' ' LEU . . . -71.74 131.67 19.0 Favored Glycine 0 N--CA 1.432 -1.603 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.734 -177.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -55.68 151.47 22.16 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 124.642 1.177 . . . . 0.0 111.66 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.2 110.67 3.05 Favored 'Trans proline' 0 C--O 1.253 1.265 0 C-N-CA 122.383 2.055 . . . . 0.0 112.209 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -114.67 144.01 44.11 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 175.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -62.19 110.31 1.58 Allowed 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.489 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.4 m120 72.73 19.28 4.01 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 125.019 1.328 . . . . 0.0 111.861 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.2 tt -144.6 93.56 2.43 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-O 121.939 0.876 . . . . 0.0 109.088 176.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -93.43 107.19 19.07 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.541 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 66.0 tp -76.84 106.12 8.31 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-O 121.938 0.875 . . . . 0.0 110.555 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.3 mm -124.36 112.99 34.56 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.929 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -86.65 -66.37 0.91 Allowed 'General case' 0 N--CA 1.425 -1.713 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.086 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 28.7 mt-30 40.84 90.39 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 O-C-N 124.684 1.24 . . . . 0.0 113.436 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.12 -154.94 6.27 Favored Glycine 0 C--N 1.288 -2.111 0 C-N-CA 119.274 -1.441 . . . . 0.0 111.744 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.5 m -116.57 137.94 51.79 Favored 'General case' 0 C--N 1.29 -2.006 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 t -134.35 154.69 51.2 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.104 0.478 . . . . 0.0 110.539 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -87.63 -12.8 44.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.355 0.598 . . . . 0.0 109.397 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.0 m -134.16 165.54 24.84 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.099 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 28.0 t -107.16 117.18 33.39 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 120.684 0.278 . . . . 0.0 110.945 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.412 ' HB3' ' ND2' ' A' ' 47' ' ' ASN . 46.4 t -82.44 117.16 22.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 173.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -94.55 57.81 2.28 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.847 1.308 . . . . 0.0 111.603 -175.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.2 p -108.29 172.28 6.93 Favored 'General case' 0 N--CA 1.413 -2.304 0 CA-C-N 114.181 -1.372 . . . . 0.0 107.929 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -87.88 -26.19 22.88 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.205 177.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -72.95 -39.62 66.05 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.412 ' ND2' ' HB3' ' A' ' 42' ' ' SER . 6.2 t30 -114.98 119.3 36.02 Favored 'General case' 0 N--CA 1.422 -1.836 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -107.47 149.27 28.13 Favored 'General case' 0 C--N 1.287 -2.124 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.8 p -122.53 145.37 48.39 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.5 p -140.49 149.19 42.2 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -122.4 71.55 1.02 Allowed 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 121.766 0.793 . . . . 0.0 109.932 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.476 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 6.9 m -149.33 151.49 34.23 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -67.42 131.95 46.68 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 65.12 21.97 12.24 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.706 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.476 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 27.7 p -73.87 -25.83 60.25 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.9 p-10 -88.24 50.84 2.05 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.276 1.036 . . . . 0.0 111.274 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.476 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 50.6 pttt . . . . . 0 C--N 1.306 -1.308 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.644 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.415 HD12 ' SG ' ' A' ' 19' ' ' CYS . 28.3 mt . . . . . 0 CA--C 1.49 -1.332 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -109.72 108.92 19.47 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.304 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.511 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 79.4 m -134.01 164.96 26.14 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.07 -173.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -84.07 81.43 8.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.417 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.464 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 9.3 tt0 -79.59 -41.62 26.72 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 121.732 0.777 . . . . 0.0 110.697 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -106.92 20.12 19.48 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 121.706 0.765 . . . . 0.0 109.871 -177.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 -24.82 14.55 Favored Glycine 0 CA--C 1.499 -0.968 0 N-CA-C 110.041 -1.223 . . . . 0.0 110.041 -176.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -105.07 158.91 16.24 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.58 121.09 22.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 O-C-N 123.634 0.584 . . . . 0.0 110.178 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.9 m -130.76 151.65 36.26 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.7 m -83.44 115.97 22.3 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.4 m -74.12 154.71 39.03 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -77.57 170.42 16.61 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 118.42 0.555 . . . . 0.0 109.792 -176.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -62.73 -25.33 68.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.187 0.595 . . . . 0.0 111.126 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -69.16 -30.78 69.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.489 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -82.89 105.29 13.78 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.591 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -94.95 -14.92 24.0 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.85 -178.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -131.21 145.35 51.89 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.34 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.415 ' SG ' HD12 ' A' ' 1' ' ' LEU . 62.3 m -109.8 133.16 53.46 Favored 'General case' 0 C--N 1.272 -2.776 0 N-CA-C 104.871 -2.27 . . . . 0.0 104.871 171.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.554 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 51.4 p90 -116.06 146.36 42.26 Favored 'General case' 0 N--CA 1.42 -1.943 0 C-N-CA 118.702 -1.199 . . . . 0.0 112.551 -177.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -124.83 102.3 7.49 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.108 -1.405 . . . . 0.0 107.639 177.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.406 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 3.3 t-20 -88.5 118.54 28.22 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 174.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.7 p -82.6 -22.11 34.92 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 123.808 0.693 . . . . 0.0 110.655 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.47 -146.75 49.11 Favored Glycine 0 N--CA 1.429 -1.807 0 N-CA-C 109.099 -1.6 . . . . 0.0 109.099 -176.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 26.5 mmt -116.82 154.88 49.57 Favored Pre-proline 0 C--N 1.279 -2.461 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 174.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -63.08 112.03 1.57 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 121.524 1.483 . . . . 0.0 110.91 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.437 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 34.4 m-85 -116.13 140.24 49.5 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.407 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -62.51 107.49 0.95 Allowed 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.908 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.9 m120 59.75 24.53 13.46 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.522 1.129 . . . . 0.0 111.167 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.77 113.02 14.19 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 121.328 0.585 . . . . 0.0 109.852 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -97.71 98.55 9.96 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -80.8 106.69 13.0 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 17.0 mm -117.32 118.26 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.915 0 CA-C-O 121.956 0.884 . . . . 0.0 113.312 -175.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.406 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 6.2 mp -123.05 77.53 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.291 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -99.27 116.22 30.94 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.023 -0.989 . . . . 0.0 108.689 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.464 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -144.8 -173.37 16.04 Favored Glycine 0 CA--C 1.479 -2.162 0 C-N-CA 119.65 -1.262 . . . . 0.0 111.803 -179.191 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.3 m -113.5 138.13 50.56 Favored 'General case' 0 C--N 1.287 -2.144 0 N-CA-C 106.329 -1.73 . . . . 0.0 106.329 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -132.5 153.24 51.11 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 t -83.91 -46.05 12.54 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -113.87 -177.03 3.03 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.3 t -140.47 129.57 23.53 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.4 m -91.3 100.28 13.11 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 167.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.93 117.55 7.76 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.751 0.786 . . . . 0.0 112.799 -171.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.487 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 1.4 p -149.63 170.21 19.2 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.127 177.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -97.77 -18.49 18.76 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.465 0.65 . . . . 0.0 109.634 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -83.5 -27.69 29.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.108 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.487 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -118.17 95.41 4.88 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 79.7 tttt -79.0 108.25 12.34 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.481 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 28.5 p -100.12 119.85 38.96 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.5 p -130.68 155.96 45.72 Favored 'General case' 0 C--N 1.275 -2.661 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -115.11 21.61 14.07 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -112.77 151.54 30.2 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -65.16 134.89 54.7 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 110.538 -0.171 . . . . 0.0 110.538 -176.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 58.77 23.25 10.98 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.485 1.116 . . . . 0.0 113.029 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.7 p -71.09 -19.5 62.45 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 121.183 0.516 . . . . 0.0 111.472 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.511 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.5 p-10 -90.23 69.41 7.13 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 122.544 1.164 . . . . 0.0 110.998 -178.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttp . . . . . 0 N--CA 1.428 -1.535 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.691 -179.3 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.424 HD12 ' SG ' ' A' ' 19' ' ' CYS . 18.5 mt . . . . . 0 CA--C 1.487 -1.462 0 CA-C-O 121.037 0.446 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -110.38 113.67 26.51 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 5.5 m -123.87 164.18 19.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -172.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.419 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 81.6 m-85 -84.87 84.02 7.85 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -71.7 -42.42 67.4 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.19 -1.004 . . . . 0.0 110.584 178.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -106.02 7.12 31.77 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.56 0.695 . . . . 0.0 109.704 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.38 -14.58 63.3 Favored Glycine 0 C--N 1.31 -0.876 0 N-CA-C 107.926 -2.07 . . . . 0.0 107.926 -170.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.2 mttm -104.96 150.75 24.65 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.3 t -73.23 122.2 25.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 123.744 0.653 . . . . 0.0 110.384 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.8 m -121.57 151.07 24.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -84.01 113.34 20.93 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.5 m -83.77 143.5 29.93 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -65.95 169.5 6.65 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.225 0.466 . . . . 0.0 110.759 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -63.81 -9.78 16.62 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 124.295 1.038 . . . . 0.0 113.09 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -82.73 -29.0 30.07 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.429 ' HA ' ' HA ' ' A' ' 39' ' ' SER . 1.3 mpt? -81.98 101.65 10.44 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.529 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.09 -6.61 31.34 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.566 -177.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -134.8 148.61 50.23 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.267 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.424 ' SG ' HD12 ' A' ' 1' ' ' LEU . 25.3 m -99.77 137.18 38.6 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 171.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -112.35 147.29 36.68 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 118.173 -1.411 . . . . 0.0 111.313 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.4 t-160 -126.7 101.57 6.68 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 114.515 -1.22 . . . . 0.0 107.823 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.509 HD21 ' HB2' ' A' ' 47' ' ' ASN . 25.2 t-20 -101.07 115.01 29.49 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 175.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.5 p -79.38 -27.86 41.9 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.094 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.38 -146.66 49.08 Favored Glycine 0 N--CA 1.427 -1.912 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.291 178.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 69.5 mtm -90.91 138.21 26.31 Favored Pre-proline 0 C--N 1.292 -1.892 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.9 123.96 9.31 Favored 'Trans proline' 0 C--O 1.252 1.185 0 C-N-CA 122.465 2.11 . . . . 0.0 110.851 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -123.84 143.33 50.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.328 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -71.05 114.43 9.09 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.698 -176.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 67.1 t30 66.33 26.51 10.26 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.9 1.28 . . . . 0.0 110.07 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -130.87 129.08 41.84 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -102.29 94.89 5.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.493 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.7 tp -78.17 109.58 12.4 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.197 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.6 mm -113.55 101.65 12.77 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.646 0 CA-C-O 121.347 0.594 . . . . 0.0 111.671 -176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.6 mp -109.64 61.48 0.6 Allowed 'General case' 0 C--N 1.306 -1.325 0 CA-C-O 122.269 1.033 . . . . 0.0 108.794 171.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -96.71 130.39 43.95 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.63 -160.41 8.76 Favored Glycine 0 C--N 1.278 -2.668 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.938 178.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 m -119.87 135.99 54.66 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.8 t -133.72 150.85 51.51 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.255 0.55 . . . . 0.0 110.82 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 16' ' ' MET . 13.1 t -77.17 -45.47 26.59 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.385 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.5 m -119.69 -175.79 3.03 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 43.2 t -125.46 138.69 54.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.003 0.43 . . . . 0.0 110.62 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.3 p -88.88 173.51 8.48 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 123.482 0.713 . . . . 0.0 110.652 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -91.92 17.73 8.83 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.112 0.482 . . . . 0.0 111.011 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.43 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 7.8 p -82.38 146.03 29.58 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.741 -175.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.08 -26.2 14.3 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -74.58 -27.16 60.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.509 ' HB2' HD21 ' A' ' 22' ' ' ASN . 8.9 t30 -115.81 96.75 5.75 Favored 'General case' 0 N--CA 1.416 -2.142 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 174.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -87.82 154.28 20.67 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.131 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 31.5 p -130.03 142.68 50.59 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 p -140.21 147.52 40.19 Favored 'General case' 0 C--N 1.278 -2.523 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 26.0 t -116.93 68.49 0.74 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.925 0.869 . . . . 0.0 110.968 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.0 m -148.78 144.99 27.37 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -69.54 130.59 42.87 Favored 'General case' 0 C--N 1.287 -2.129 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.499 -177.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.4 mtp-105 69.19 26.4 5.48 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.599 1.159 . . . . 0.0 111.524 -178.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.463 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 28.4 p -78.71 -26.37 44.83 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 178.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.424 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 32.3 p-10 -83.45 70.61 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.839 1.304 . . . . 0.0 110.044 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.47 ' HB2' ' HZ1' ' A' ' 57' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.428 -1.541 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.896 -172.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.431 HD12 ' SG ' ' A' ' 19' ' ' CYS . 19.5 mt . . . . . 0 CA--C 1.478 -1.807 0 CA-C-O 120.556 0.217 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 10.5 ptpp? -109.23 112.34 24.44 Favored 'General case' 0 N--CA 1.414 -2.238 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 174.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.549 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 74.0 m -136.26 165.06 26.64 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.197 -175.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.434 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 92.7 m-85 -82.02 63.0 6.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.415 0.626 . . . . 0.0 110.611 -176.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.453 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 8.2 tt0 -70.61 -31.99 69.17 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.927 -175.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -106.21 -7.36 17.9 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 122.155 0.979 . . . . 0.0 109.297 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.39 -18.07 30.61 Favored Glycine 0 C--N 1.305 -1.146 0 N-CA-C 108.099 -2.001 . . . . 0.0 108.099 -171.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 62.2 mttp -104.76 155.54 18.79 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.538 -1.331 . . . . 0.0 107.649 175.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.8 t -73.18 108.24 4.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 29.5 m -123.54 151.04 27.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 94.6 m -82.37 108.18 15.6 Favored 'General case' 0 N--CA 1.418 -2.073 0 CA-C-O 121.475 0.655 . . . . 0.0 109.524 176.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 58.3 m -76.7 136.94 39.11 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 176.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -57.21 162.35 2.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.568 0.747 . . . . 0.0 111.227 -172.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -62.33 -17.42 58.8 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -176.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.406 ' O ' ' HA ' ' A' ' 39' ' ' SER . 7.0 m-20 -71.01 -30.35 66.56 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.756 0.789 . . . . 0.0 109.117 176.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -79.03 101.41 7.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.451 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -91.92 -22.19 20.18 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.028 -178.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -127.42 137.31 52.69 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.479 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.431 ' SG ' HD12 ' A' ' 1' ' ' LEU . 60.2 m -103.49 127.82 50.81 Favored 'General case' 0 C--N 1.279 -2.468 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -109.57 159.73 16.84 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.767 -0.773 . . . . 0.0 111.948 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.415 ' NE2' ' HB ' ' A' ' 23' ' ' THR . 7.8 t-160 -129.99 101.46 5.85 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.859 177.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.505 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.0 t-20 -101.36 118.23 36.56 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.415 ' HB ' ' NE2' ' A' ' 21' ' ' HIS . 8.9 t -118.63 134.66 54.95 Favored 'General case' 0 C--N 1.287 -2.122 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.063 -177.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.37 171.88 48.33 Favored Glycine 0 N--CA 1.432 -1.578 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 176.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 64.4 mtt -75.9 147.04 80.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.83 106.08 0.6 Allowed 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 122.401 2.067 . . . . 0.0 112.892 -178.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -121.97 144.34 48.94 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -58.18 121.64 11.21 Favored 'General case' 0 C--O 1.242 0.709 0 O-C-N 123.402 0.439 . . . . 0.0 110.578 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 69.05 7.68 6.38 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.682 1.193 . . . . 0.0 112.502 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.6 tp -126.95 102.88 7.19 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.103 0.477 . . . . 0.0 110.654 -178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -110.64 98.98 8.02 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 tp -93.61 106.13 18.12 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.263 0.554 . . . . 0.0 109.58 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.4 mm -123.69 112.21 32.24 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.264 178.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.505 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.1 mt -119.83 70.55 0.86 Allowed 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 121.691 0.758 . . . . 0.0 109.203 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -86.06 118.73 25.71 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 173.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.453 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -139.53 -160.17 8.25 Favored Glycine 0 N--CA 1.425 -2.042 0 C-N-CA 120.002 -1.094 . . . . 0.0 112.506 -175.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.46 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 74.1 m -135.13 135.75 41.37 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 t -133.78 156.56 47.78 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 121.305 0.574 . . . . 0.0 110.836 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 18.2 m -76.59 -33.47 58.44 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.082 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.1 m -141.92 139.31 32.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.64 165.41 11.45 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.4 p -95.6 169.17 10.22 Favored 'General case' 0 N--CA 1.42 -1.94 0 C-N-CA 124.5 1.12 . . . . 0.0 110.566 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -93.34 27.93 2.4 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.612 0.72 . . . . 0.0 110.144 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.466 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.7 p -74.88 144.15 43.5 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.678 -178.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.39 -29.34 18.09 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -73.08 -44.34 60.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.102 176.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.466 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -93.15 99.17 11.8 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 176.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -89.29 151.61 22.01 Favored 'General case' 0 C--N 1.282 -2.327 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.5 -174.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.0 p -147.16 144.49 29.02 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.7 p -139.51 155.51 47.49 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 114.49 -1.232 . . . . 0.0 107.822 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -113.63 32.77 5.58 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.1 m -119.95 150.4 40.56 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -65.69 129.92 41.48 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.533 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 61.81 27.09 16.51 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.491 -1.232 . . . . 0.0 112.577 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 30.1 p -77.56 -25.14 49.8 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.446 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.549 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -83.59 73.8 10.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 122.947 1.356 . . . . 0.0 110.315 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.294 -1.832 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.271 -177.044 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.412 HD11 ' SG ' ' A' ' 19' ' ' CYS . 30.8 mt . . . . . 0 CA--C 1.488 -1.423 0 CA-C-O 121.203 0.525 . . . . 0.0 111.905 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.401 ' HB2' ' CG1' ' A' ' 9' ' ' VAL . 20.3 pttp -110.77 113.95 26.93 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.203 172.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.493 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 85.0 m -135.82 164.02 28.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.274 0.559 . . . . 0.0 112.212 -174.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -81.39 85.02 6.51 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 122.129 -0.357 . . . . 0.0 111.324 -174.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.526 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 10.0 tt0 -81.4 -43.2 19.31 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.754 -1.178 . . . . 0.0 112.103 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -107.0 19.35 20.57 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.578 0.704 . . . . 0.0 111.259 -178.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.13 -38.05 3.46 Favored Glycine 0 CA--C 1.497 -1.049 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 -176.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -100.5 163.44 12.36 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.401 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 41.0 t -72.86 132.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 O-C-N 123.557 0.536 . . . . 0.0 111.244 -176.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -126.41 152.09 33.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 174.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.45 120.46 29.84 Favored 'General case' 0 C--N 1.283 -2.317 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.947 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.4 m -80.47 143.88 33.01 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -74.07 169.35 17.68 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.11 -7.59 42.73 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.8 -29.64 56.08 Favored 'General case' 0 CA--C 1.495 -1.141 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -77.91 126.52 30.97 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.326 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -108.18 -24.92 11.32 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.156 -175.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -133.73 143.63 48.6 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.204 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.412 ' SG ' HD11 ' A' ' 1' ' ' LEU . 61.6 m -102.56 119.9 39.62 Favored 'General case' 0 C--N 1.278 -2.51 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 170.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.421 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.9 p90 -99.59 149.53 23.17 Favored 'General case' 0 N--CA 1.42 -1.926 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.811 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 -125.73 101.82 7.04 Favored 'General case' 0 C--N 1.278 -2.523 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.855 178.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -110.3 106.91 16.47 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 176.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.2 t -100.37 170.89 8.11 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.69 -165.17 29.32 Favored Glycine 0 C--N 1.3 -1.446 0 C-N-CA 119.738 -1.22 . . . . 0.0 111.047 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 86.1 mtp -74.06 133.48 78.53 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.4 104.47 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.902 1.735 . . . . 0.0 112.975 -176.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -133.21 143.67 49.3 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 114.865 -1.062 . . . . 0.0 108.444 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.488 ' HA ' ' NE ' ' A' ' 28' ' ' ARG . 2.0 mmp_? -70.79 129.82 40.09 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 73.69 17.05 3.75 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.652 1.181 . . . . 0.0 111.201 -176.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.79 91.58 3.59 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -104.04 105.14 15.22 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 68.0 tp -104.54 106.69 17.28 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 mm -103.66 103.39 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.094 0 CA-C-O 121.809 0.814 . . . . 0.0 111.147 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.2 mt -123.58 63.53 1.03 Allowed 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 170.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 21.3 mt-30 -109.5 114.95 29.01 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.974 -1.467 . . . . 0.0 107.247 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.55 -170.72 13.97 Favored Glycine 0 C--N 1.286 -2.209 0 C-N-CA 119.314 -1.422 . . . . 0.0 112.174 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 20.8 m -111.44 132.14 54.69 Favored 'General case' 0 C--N 1.285 -2.219 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -133.85 154.32 51.11 Favored 'General case' 0 C--N 1.302 -1.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.755 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -86.69 -11.3 51.63 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.358 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.5 m -141.47 -169.05 2.79 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.7 t -148.7 151.55 35.11 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.7 t -114.03 110.48 20.11 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 170.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -70.81 97.33 1.37 Allowed 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 122.825 1.298 . . . . 0.0 111.273 -176.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.9 p -135.91 178.15 7.28 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.962 -176.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -94.95 -28.21 15.28 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.344 0.592 . . . . 0.0 109.752 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -88.3 -36.6 16.58 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -102.76 106.08 16.63 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -94.07 153.67 18.02 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.146 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.2 m -132.31 124.84 29.61 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.6 p -129.59 147.11 51.35 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -114.48 25.67 10.84 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.5 m -114.05 147.02 39.4 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -66.87 133.04 49.26 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.4 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 66.19 18.77 11.02 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 124.83 1.252 . . . . 0.0 112.693 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.5 p -65.35 -31.87 73.22 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.101 0.477 . . . . 0.0 111.685 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.493 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 36.9 p-10 -83.87 47.51 1.31 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.175 0.988 . . . . 0.0 111.107 -176.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt . . . . . 0 C--O 1.249 1.054 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.011 178.884 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.471 HD11 ' SG ' ' A' ' 19' ' ' CYS . 33.9 mt . . . . . 0 CA--C 1.472 -2.048 0 CA-C-O 120.712 0.291 . . . . 0.0 110.915 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.43 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 23.3 pttm -109.04 106.68 16.72 Favored 'General case' 0 N--CA 1.411 -2.409 0 CA-C-O 121.615 0.722 . . . . 0.0 109.121 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 85.3 m -131.07 166.14 21.71 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.83 -174.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -77.37 74.3 3.93 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.41 ' HA ' ' HA2' ' A' ' 36' ' ' GLY . 1.0 OUTLIER -85.85 -42.04 14.47 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.669 0.747 . . . . 0.0 109.337 178.324 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -100.42 20.46 14.83 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 122.329 1.061 . . . . 0.0 108.939 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.54 -35.66 3.79 Favored Glycine 0 CA--C 1.496 -1.141 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -176.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -104.46 163.13 12.67 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.9 t -68.09 114.37 4.87 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 123.893 0.746 . . . . 0.0 109.043 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.8 m -128.85 151.98 36.38 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.445 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.7 m -76.3 106.27 7.82 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.0 m -79.49 144.62 33.82 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -63.68 167.77 5.51 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.331 0.652 . . . . 0.0 112.466 -170.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -55.53 -23.31 25.73 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 125.064 1.346 . . . . 0.0 112.595 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.404 ' O ' ' HA ' ' A' ' 39' ' ' SER . 15.7 m-20 -84.35 -26.62 28.31 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -175.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -74.32 101.67 4.12 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.25 -177.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -94.42 -22.83 18.05 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.01 -177.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -128.39 148.41 50.69 Favored 'General case' 0 N--CA 1.429 -1.525 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.369 -173.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.471 ' SG ' HD11 ' A' ' 1' ' ' LEU . 57.3 m -106.32 136.22 46.44 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 104.565 -2.383 . . . . 0.0 104.565 170.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.45 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 43.4 p90 -125.59 152.98 44.38 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.87 -174.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.7 t-160 -130.4 102.61 6.25 Favored 'General case' 0 N--CA 1.421 -1.904 0 CA-C-N 113.886 -1.506 . . . . 0.0 107.007 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.493 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 5.0 t30 -90.27 102.29 15.02 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.0 p -67.85 -43.34 79.71 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.228 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.34 -152.52 41.66 Favored Glycine 0 N--CA 1.424 -2.121 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -176.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.456 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.2 mpp? -85.13 142.36 38.31 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.66 114.92 3.29 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.098 1.866 . . . . 0.0 109.947 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 52.3 m-85 -117.47 140.66 49.31 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 121.567 0.698 . . . . 0.0 110.614 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -91.87 127.88 37.5 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.726 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 65.9 t30 68.75 22.39 7.39 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.357 1.063 . . . . 0.0 110.064 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.1 tp -143.52 135.07 26.25 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.63 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -110.06 99.5 8.58 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.097 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -81.1 106.12 12.85 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 176.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 23.0 mm -112.15 115.01 48.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 CA-C-O 121.637 0.732 . . . . 0.0 112.74 -174.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 81.8 mt -133.94 72.84 1.48 Allowed 'General case' 0 N--CA 1.423 -1.808 0 CA-C-N 113.72 -1.582 . . . . 0.0 107.436 172.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -112.89 110.0 19.8 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.935 -177.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.41 ' HA2' ' HA ' ' A' ' 5' ' ' GLN . . . -145.19 -154.34 6.12 Favored Glycine 0 C--N 1.295 -1.75 0 C-N-CA 119.707 -1.235 . . . . 0.0 112.582 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.1 m -126.96 136.16 51.88 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 175.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.2 t -122.34 144.25 49.13 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.557 0.694 . . . . 0.0 111.663 -173.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 15.9 m -86.14 -30.2 22.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.724 178.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.2 m -142.19 104.27 4.42 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.0 t -116.52 136.85 52.64 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.634 -167.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.4 m -96.45 105.55 17.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.63 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -66.46 104.95 1.35 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.598 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -137.8 175.05 9.94 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.86 -36.52 64.87 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -63.76 -59.91 3.97 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.073 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 8.0 t30 -106.45 105.01 14.84 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.271 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.45 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 39.2 ttpt -86.22 116.71 24.57 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.17 -178.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 20.7 m -104.75 132.55 50.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.2 p -139.92 155.6 47.09 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.4 p -126.62 72.71 1.35 Allowed 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.819 0.819 . . . . 0.0 111.73 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.45 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 4.6 m -149.35 151.29 33.87 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 175.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.43 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 11.3 m-20 -66.86 126.08 27.93 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -177.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 69.93 18.88 7.16 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.499 1.52 . . . . 0.0 112.689 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.45 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.5 p -70.4 -20.35 62.94 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -176.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 28.9 p-10 -89.52 33.77 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.553 0.692 . . . . 0.0 110.786 -177.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 C--N 1.314 -0.935 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.574 -179.266 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 21.5 mt . . . . . 0 CA--C 1.497 -1.09 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -110.91 116.18 30.79 Favored 'General case' 0 C--N 1.278 -2.518 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 169.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.5 m -133.78 165.22 25.48 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-O 121.125 0.488 . . . . 0.0 111.567 -172.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.557 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.6 m-85 -83.65 86.57 7.1 Favored 'General case' 0 C--O 1.189 -2.087 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 -174.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -76.88 -41.48 43.6 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.033 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -105.85 12.17 31.05 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.555 -177.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.77 -10.53 72.0 Favored Glycine 0 CA--C 1.517 0.217 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -171.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.531 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.3 mttt -105.51 153.29 21.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 28.0 t -76.93 108.89 10.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 O-C-N 123.316 0.385 . . . . 0.0 110.152 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.4 m -123.85 151.26 28.59 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.8 m -82.75 129.25 34.95 Favored 'General case' 0 C--N 1.285 -2.218 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -178.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 60.4 m -74.05 158.08 34.93 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.596 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 20.9 t-80 -70.71 165.53 22.79 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 -176.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -68.59 3.73 1.71 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -176.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.71 -12.75 15.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.552 0.692 . . . . 0.0 109.332 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.596 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -86.9 117.2 25.48 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.703 -172.033 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -104.57 -21.54 13.41 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.344 -1.298 . . . . 0.0 109.907 -177.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -128.86 150.0 50.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.84 -177.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 64.9 m -109.26 136.87 48.01 Favored 'General case' 0 C--N 1.276 -2.611 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -120.54 152.82 37.57 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.051 -176.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -134.68 101.87 5.09 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 47' ' ' ASN . 5.2 t30 -97.74 104.7 16.75 Favored 'General case' 0 CA--C 1.485 -1.532 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.3 p -66.14 -36.47 83.22 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 123.797 0.686 . . . . 0.0 112.131 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.63 -132.09 29.36 Favored Glycine 0 N--CA 1.427 -1.945 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.39 124.28 36.22 Favored Pre-proline 0 C--N 1.282 -2.334 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -79.07 120.02 4.46 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.545 2.164 . . . . 0.0 111.37 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -117.16 142.96 46.36 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -66.88 125.68 26.68 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.972 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 68.13 21.97 8.47 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.815 1.246 . . . . 0.0 111.586 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.7 tp -141.25 103.04 4.35 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.339 0.59 . . . . 0.0 111.092 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -83.75 98.25 9.58 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 tt -77.17 106.4 8.86 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 177.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 26.1 mm -104.57 111.26 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.743 -172.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.439 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 62.0 mt -126.28 59.33 1.34 Allowed 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.192 -1.367 . . . . 0.0 108.057 172.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -93.5 125.38 38.08 Favored 'General case' 0 N--CA 1.421 -1.898 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 176.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.4 -163.61 10.49 Favored Glycine 0 C--N 1.27 -3.124 0 C-N-CA 119.204 -1.475 . . . . 0.0 112.961 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 60.9 m -131.49 134.94 46.66 Favored 'General case' 0 C--N 1.286 -2.185 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 t -134.01 162.45 32.04 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.317 0.58 . . . . 0.0 110.217 -176.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -90.82 -15.73 29.53 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 177.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.4 m -132.7 -171.26 2.62 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.359 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.8 t -121.66 165.52 15.63 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.9 p -80.39 165.1 22.56 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 123.73 0.812 . . . . 0.0 112.007 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -85.83 -20.84 28.54 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.934 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 t -99.47 156.5 17.0 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.843 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -89.47 -15.61 32.69 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 123.972 0.795 . . . . 0.0 109.465 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -58.19 -32.12 67.95 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 122.618 1.199 . . . . 0.0 109.019 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 6.4 t30 -105.58 113.95 27.82 Favored 'General case' 0 N--CA 1.409 -2.502 0 CA-C-N 113.508 -1.678 . . . . 0.0 107.788 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -89.08 142.27 27.78 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.1 p -124.7 135.71 53.27 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.1 p -139.92 156.65 46.57 Favored 'General case' 0 C--N 1.269 -2.906 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 p -117.72 29.12 8.02 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -173.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.0 m -129.14 154.43 46.73 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.059 0.457 . . . . 0.0 110.985 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -50.98 124.51 11.48 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.06 0.944 . . . . 0.0 112.363 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 58.29 27.43 15.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.579 1.151 . . . . 0.0 113.68 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.2 p -76.59 -25.12 53.6 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -87.31 33.67 0.69 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -171.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.557 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 14.4 ptmm? . . . . . 0 C--N 1.302 -1.471 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.457 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.439 HD12 ' SG ' ' A' ' 19' ' ' CYS . 27.7 mt . . . . . 0 CA--C 1.479 -1.769 0 CA-C-O 121.574 0.702 . . . . 0.0 111.773 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 47.4 pttt -109.75 108.56 18.96 Favored 'General case' 0 C--N 1.28 -2.449 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.843 174.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.554 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 71.9 m -133.23 165.12 25.54 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.788 -173.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.432 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 91.8 m-85 -81.98 74.19 8.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.237 0.541 . . . . 0.0 110.623 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.485 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.2 tt0 -85.04 -35.83 21.63 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-O 121.444 0.64 . . . . 0.0 112.103 -177.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -105.81 9.44 32.91 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 122.26 1.029 . . . . 0.0 108.336 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 103.39 -38.33 3.28 Favored Glycine 0 CA--C 1.498 -1.009 0 N-CA-C 108.252 -1.939 . . . . 0.0 108.252 -174.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -93.05 162.81 13.89 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 113.925 -1.137 . . . . 0.0 108.217 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.405 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 57.6 t -71.77 123.2 25.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 16.5 m -120.48 152.12 23.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.67 103.02 15.54 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.7 m -82.43 142.06 32.25 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -69.66 170.88 9.95 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.4 mtm180 -76.32 -4.16 40.64 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -69.26 -31.62 70.27 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 171.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -82.14 101.32 10.35 Favored 'General case' 0 N--CA 1.422 -1.839 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.853 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -102.37 -8.27 21.32 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.278 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -134.71 136.11 42.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.257 -178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.439 ' SG ' HD12 ' A' ' 1' ' ' LEU . 82.9 m -101.69 136.41 41.57 Favored 'General case' 0 C--N 1.28 -2.447 0 N-CA-C 105.25 -2.129 . . . . 0.0 105.25 170.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.406 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 51.3 p90 -120.72 147.35 45.41 Favored 'General case' 0 C--N 1.293 -1.852 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.335 -176.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.451 ' NE2' ' HB ' ' A' ' 23' ' ' THR . 12.8 t-160 -120.21 102.31 8.41 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.477 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 6.3 t30 -104.64 102.82 12.4 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.451 ' HB ' ' NE2' ' A' ' 21' ' ' HIS . 9.9 t -102.04 -162.96 0.97 Allowed 'General case' 0 C--N 1.273 -2.72 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.32 -102.68 0.27 Allowed Glycine 0 N--CA 1.416 -2.66 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.1 mtt -128.38 157.84 73.37 Favored Pre-proline 0 C--N 1.285 -2.228 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.65 105.46 1.1 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.4 1.4 . . . . 0.0 110.224 176.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -91.21 143.69 26.4 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.115 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.67 118.0 20.35 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.115 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 66.32 18.91 10.99 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.921 0.888 . . . . 0.0 111.735 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.0 tp -145.67 132.14 19.73 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -117.53 106.35 13.05 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 66.3 tp -80.96 106.22 12.79 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 25.1 mm -115.24 96.52 4.68 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.142 -177.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 84.2 mt -106.77 61.32 0.63 Allowed 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 173.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.485 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 23.5 mt-30 -97.93 120.13 37.77 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.439 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -145.84 -163.3 10.19 Favored Glycine 0 C--N 1.284 -2.325 0 C-N-CA 119.813 -1.184 . . . . 0.0 112.636 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.0 m -122.17 137.68 54.74 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 173.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -133.68 157.43 45.83 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 t -81.37 -43.25 19.27 Favored 'General case' 0 N--CA 1.416 -2.127 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.0 p -105.58 178.85 4.44 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.9 t -120.52 126.65 50.89 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.491 0.186 . . . . 0.0 110.906 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.1 m -82.0 85.33 6.74 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.31 99.97 0.77 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.639 1.209 . . . . 0.0 113.023 -173.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -148.82 175.74 10.99 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-N 113.012 -1.904 . . . . 0.0 107.006 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -89.86 -32.55 16.84 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.052 0.454 . . . . 0.0 110.968 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -79.31 -36.91 38.86 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.807 0.337 . . . . 0.0 111.4 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -94.31 99.58 11.78 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 174.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -89.99 114.53 26.39 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.516 -174.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 32.0 p -104.2 136.02 44.59 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.38 176.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.7 p -139.54 155.6 47.41 Favored 'General case' 0 C--N 1.282 -2.361 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.997 -179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -112.3 25.83 11.15 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.7 m -116.36 148.53 40.53 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -66.02 126.05 27.38 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 120.734 0.302 . . . . 0.0 111.175 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 65.7 24.75 11.53 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 124.843 1.257 . . . . 0.0 112.396 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.1 p -70.92 -19.56 62.57 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.177 0.513 . . . . 0.0 111.863 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.554 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 36.4 p-10 -89.43 70.54 8.06 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 122.469 1.128 . . . . 0.0 110.522 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.432 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 22.0 pttp . . . . . 0 C--N 1.306 -1.32 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.971 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 34.7 mt . . . . . 0 CA--C 1.484 -1.564 0 CA-C-O 120.858 0.361 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -110.92 113.58 26.26 Favored 'General case' 0 N--CA 1.415 -2.186 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.6 m -128.5 164.22 23.26 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.439 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 89.9 m-85 -82.78 76.94 9.6 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 122.37 -0.206 . . . . 0.0 111.371 -177.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.542 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.6 tt0 -77.92 -42.37 33.37 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.509 0.671 . . . . 0.0 111.187 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -90.91 -2.26 57.75 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.06 -14.96 62.17 Favored Glycine 0 C--N 1.307 -1.079 0 N-CA-C 107.242 -2.343 . . . . 0.0 107.242 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.4 mttt -105.03 155.82 18.62 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.3 t -70.87 113.13 6.52 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.1 m -125.88 152.22 32.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 16.1 m -82.37 126.62 32.39 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-O 121.185 0.517 . . . . 0.0 110.227 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.9 m -82.74 153.63 25.19 Favored 'General case' 0 C--N 1.297 -1.707 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.407 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.8 t-80 -67.62 160.88 26.97 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -178.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -62.88 -12.55 25.72 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -176.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -81.89 -24.34 35.75 Favored 'General case' 0 CA--C 1.504 -0.818 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.407 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.3 OUTLIER -73.51 126.0 29.23 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.699 -172.909 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -113.19 -24.25 9.52 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.13 -175.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -130.43 148.56 52.26 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.074 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.9 m -96.26 142.52 28.32 Favored 'General case' 0 C--N 1.286 -2.153 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 169.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.427 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 45.5 p90 -123.17 154.53 38.57 Favored 'General case' 0 C--N 1.294 -1.811 0 C-N-CA 118.466 -1.293 . . . . 0.0 111.429 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -131.97 106.05 7.8 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 174.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.429 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 27.0 t-20 -97.08 133.29 41.94 Favored 'General case' 0 C--N 1.289 -2.058 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 175.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.65 -164.35 1.8 Allowed 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -163.97 -75.65 0.03 OUTLIER Glycine 0 CA--C 1.476 -2.378 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 178.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 88.0 mtp -137.55 157.56 73.55 Favored Pre-proline 0 C--N 1.274 -2.71 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 175.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.62 143.64 24.33 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.946 1.764 . . . . 0.0 109.536 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.406 ' CB ' ' HB3' ' A' ' 30' ' ' LEU . 83.6 m-85 -116.18 142.9 46.21 Favored 'General case' 0 C--N 1.281 -2.4 0 CA-C-O 121.303 0.573 . . . . 0.0 112.221 -178.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -65.98 104.64 1.16 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.204 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 71.31 19.43 5.34 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 124.564 1.145 . . . . 0.0 111.301 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB3' ' CB ' ' A' ' 27' ' ' PHE . 66.0 tp -126.89 105.16 8.44 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -81.83 92.44 6.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 tt -82.9 106.26 14.58 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 20.9 mm -124.01 96.78 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.614 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.91 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.429 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 10.1 mp -104.98 60.91 0.69 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 170.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.542 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 25.8 mt-30 -103.45 126.52 50.65 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.583 -1.189 . . . . 0.0 108.262 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.04 -158.14 7.52 Favored Glycine 0 C--N 1.265 -3.39 0 C-N-CA 119.713 -1.232 . . . . 0.0 111.227 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 27.0 m -128.32 134.52 48.91 Favored 'General case' 0 C--N 1.281 -2.383 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.0 t -133.6 157.26 46.18 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.299 0.571 . . . . 0.0 110.245 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -87.8 -15.77 35.97 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.015 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.8 t -141.35 174.15 10.81 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.7 t -113.95 148.95 36.0 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 t -92.0 161.44 14.79 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -90.93 -12.45 36.01 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.985 0.421 . . . . 0.0 110.91 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -79.37 144.02 34.55 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-O 121.013 0.435 . . . . 0.0 110.478 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -2.88 53.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.991 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -76.89 -17.44 58.94 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.686 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -120.93 104.66 9.99 Favored 'General case' 0 N--CA 1.428 -1.572 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 53.4 mtpt -84.64 125.44 32.48 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.381 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.1 m -110.85 134.62 52.38 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.5 p -139.99 144.08 36.81 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -113.89 49.25 1.0 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -138.55 147.19 42.79 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 106.136 -1.801 . . . . 0.0 106.136 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -66.95 136.37 55.24 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.058 -177.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 63.72 19.77 11.89 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.438 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.0 p -68.12 -26.99 66.07 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.971 0.415 . . . . 0.0 110.841 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.441 HD21 ' HB3' ' A' ' 35' ' ' GLN . 36.2 p-10 -82.81 55.14 2.93 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 122.934 1.349 . . . . 0.0 111.09 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt . . . . . 0 N--CA 1.43 -1.474 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.196 -179.508 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.539 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 35.9 mt . . . . . 0 CA--C 1.482 -1.665 0 CA-C-O 121.095 0.474 . . . . 0.0 111.635 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -109.93 112.51 24.57 Favored 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 172.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.539 ' SG ' ' HB3' ' A' ' 1' ' ' LEU . 3.6 m -129.63 163.99 24.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.025 0.44 . . . . 0.0 110.622 -170.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.527 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 93.1 m-85 -81.36 90.48 6.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -83.95 -42.78 15.91 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.189 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -106.48 14.69 26.86 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.587 0.708 . . . . 0.0 109.181 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.2 -16.41 61.36 Favored Glycine 0 C--N 1.31 -0.91 0 N-CA-C 108.634 -1.786 . . . . 0.0 108.634 -172.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 92.1 mttt -105.09 159.01 16.17 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 56.3 t -81.4 119.05 30.24 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 123.612 0.57 . . . . 0.0 110.366 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.2 m -118.74 151.66 20.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.1 m -85.06 110.7 19.13 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.194 0.521 . . . . 0.0 109.752 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.4 m -85.77 140.76 30.2 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.986 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.401 ' CG ' ' H ' ' A' ' 14' ' ' ARG . 20.6 t-80 -71.42 172.35 9.62 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.769 -171.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.401 ' H ' ' CG ' ' A' ' 13' ' ' HIS . 98.9 mtt180 -66.9 -10.55 49.82 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.506 1.122 . . . . 0.0 112.576 -177.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -73.94 -31.3 62.99 Favored 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 174.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -86.8 114.13 23.21 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.814 -175.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -102.45 -16.28 16.23 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.964 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -134.25 145.27 48.98 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.091 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.519 ' SG ' HD13 ' A' ' 1' ' ' LEU . 33.7 m -92.74 140.81 29.14 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 168.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.506 ' CD2' ' HB2' ' A' ' 38' ' ' SER . 47.8 p90 -127.08 145.26 50.8 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.222 -1.391 . . . . 0.0 111.959 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -120.99 101.14 7.48 Favored 'General case' 0 C--N 1.274 -2.695 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 172.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.473 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.4 t-20 -104.48 138.05 41.44 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.4 t -162.4 -172.49 3.19 Favored 'General case' 0 N--CA 1.402 -2.869 0 N-CA-C 106.056 -1.831 . . . . 0.0 106.056 -177.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -139.08 -142.83 4.33 Favored Glycine 0 CA--C 1.481 -2.078 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -178.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.2 mtt -87.39 156.7 53.75 Favored Pre-proline 0 C--N 1.289 -2.047 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.09 106.39 1.71 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 121.709 1.606 . . . . 0.0 111.372 176.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -107.43 138.24 43.99 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.3 mtp180 -60.04 123.81 18.27 Favored 'General case' 0 C--N 1.319 -0.731 0 O-C-N 123.124 0.265 . . . . 0.0 110.839 -177.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 69.75 4.99 4.99 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.757 1.223 . . . . 0.0 113.365 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.8 tp -120.2 88.82 3.01 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-O 121.575 0.702 . . . . 0.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -87.55 87.63 7.45 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.496 ' H ' HD22 ' A' ' 32' ' ' LEU . 2.2 pt? -82.17 113.1 19.77 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 121.658 0.742 . . . . 0.0 110.385 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.7 mm -123.51 111.86 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.604 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.473 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 91.0 mt -124.64 67.98 1.09 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.002 175.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -94.1 112.7 24.54 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.496 177.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.95 -158.15 7.52 Favored Glycine 0 C--N 1.283 -2.382 0 C-N-CA 120.104 -1.046 . . . . 0.0 110.927 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.7 m -123.87 134.34 53.59 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 175.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.506 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 45.7 t -112.37 144.59 41.56 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.263 0.554 . . . . 0.0 111.173 -173.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.8 m -86.46 -35.08 19.87 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 114.986 -1.007 . . . . 0.0 108.381 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.9 p -149.73 122.05 8.42 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.485 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.9 t -79.72 148.36 31.56 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.1 m -89.3 116.01 27.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 173.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -66.55 99.27 0.57 Allowed 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 122.241 1.019 . . . . 0.0 112.717 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.647 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.1 p -141.94 179.34 6.93 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.072 -179.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -94.95 -52.23 4.33 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.358 -178.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -76.76 -25.83 53.88 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.249 -173.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.647 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t30 -81.61 105.21 12.58 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 57.8 mtpt -88.3 120.32 29.55 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.736 -174.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.2 m -121.8 126.26 48.39 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -139.9 155.43 47.19 Favored 'General case' 0 C--N 1.284 -2.264 0 C-N-CA 121.28 -0.168 . . . . 0.0 110.71 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -104.75 32.91 3.84 Favored 'General case' 0 CA--C 1.558 1.254 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -173.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.2 p -130.47 147.26 52.14 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 121.733 -0.604 . . . . 0.0 111.421 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.456 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 75.2 m-20 -57.13 133.94 55.45 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.185 -177.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 78.6 mtm180 64.14 16.19 9.84 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 125.049 1.34 . . . . 0.0 114.031 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 25.6 p -75.96 -14.28 60.24 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.172 -0.611 . . . . 0.0 112.249 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -87.34 30.62 0.78 Allowed 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.641 -0.662 . . . . 0.0 111.454 -176.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.507 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 13.5 ptmm? . . . . . 0 C--O 1.254 1.319 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.511 HD13 ' SG ' ' A' ' 19' ' ' CYS . 19.1 mt . . . . . 0 CA--C 1.486 -1.484 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 36.2 pttt -109.93 110.43 21.38 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.183 172.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.512 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 72.9 m -136.9 164.34 28.56 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.984 -175.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 54' ' ' ARG . 82.7 m-85 -84.4 81.58 8.77 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -176.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.495 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.1 tt0 -84.74 -42.94 14.75 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.223 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -106.17 19.07 21.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 -177.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.48 -38.59 3.15 Favored Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.45 153.8 24.28 Favored 'General case' 0 N--CA 1.426 -1.639 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.2 t -69.73 111.58 3.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 13.0 m -111.31 152.04 13.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.7 m -89.12 117.38 28.07 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.4 m -74.35 156.38 37.15 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.117 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.664 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.9 t-80 -64.29 160.57 18.47 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.87 0.868 . . . . 0.0 110.695 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -53.17 -40.47 64.38 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.451 1.1 . . . . 0.0 109.522 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -79.86 -8.52 59.34 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.571 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.664 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.4 OUTLIER -92.37 101.38 13.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 121.717 0.77 . . . . 0.0 109.598 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -88.46 -19.49 26.42 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.17 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -135.05 155.46 50.71 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.511 ' SG ' HD13 ' A' ' 1' ' ' LEU . 86.3 m -113.47 145.78 40.63 Favored 'General case' 0 C--N 1.279 -2.486 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 171.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.1 p90 -124.61 150.59 45.81 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.421 -178.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 -127.24 111.94 14.53 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 177.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -102.27 105.85 16.56 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.496 ' O ' ' HA ' ' A' ' 46' ' ' ASN . 12.8 t -153.46 159.98 42.45 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.86 -51.73 0.7 Allowed Glycine 0 CA--C 1.467 -2.947 0 N-CA-C 108.099 -2.0 . . . . 0.0 108.099 -177.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 19.0 ptp -74.6 128.27 85.89 Favored Pre-proline 0 C--N 1.287 -2.149 0 CA-C-N 113.675 -1.262 . . . . 0.0 108.6 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -83.37 150.28 13.34 Favored 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 122.616 2.21 . . . . 0.0 111.783 -178.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -127.61 134.64 49.67 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.494 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -111.26 134.37 52.9 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.823 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.67 19.93 11.7 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.394 1.078 . . . . 0.0 111.562 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.7 tp -168.33 149.35 4.93 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 tptt -128.5 87.84 2.65 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 173.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -87.35 111.24 20.88 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.8 tp -122.67 99.29 6.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 CA-C-O 121.669 0.747 . . . . 0.0 109.625 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.1 mt -85.0 85.34 7.49 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.994 0.902 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.495 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 9.3 pt20 -116.59 107.73 15.08 Favored 'General case' 0 C--N 1.276 -2.602 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.393 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.22 -150.85 5.33 Favored Glycine 0 C--N 1.295 -1.7 0 C-N-CA 119.907 -1.14 . . . . 0.0 112.596 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.5 m -120.39 136.81 54.6 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.2 t -133.99 154.6 51.01 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 121.572 0.701 . . . . 0.0 111.229 -177.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.3 t -80.85 -20.99 41.12 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.491 177.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.1 p -127.64 170.21 12.92 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 120.763 0.316 . . . . 0.0 111.672 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 45.3 t -127.03 104.01 7.77 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 m -97.2 96.47 8.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -78.89 103.98 9.21 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.051 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.1 p -134.93 176.76 8.36 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -81.91 -28.82 32.64 Favored 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.0 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.496 ' HA ' ' O ' ' A' ' 23' ' ' THR . 7.8 t30 -81.95 -47.24 12.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -103.11 106.45 16.97 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 94.6 mttt -101.57 120.17 39.9 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.919 -177.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 p -110.24 130.49 55.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.268 0.556 . . . . 0.0 111.49 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.0 p -139.42 156.5 46.93 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.062 0.945 . . . . 0.0 110.566 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.7 m -118.41 28.77 8.14 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.6 p -111.77 153.28 26.75 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 121.542 -0.724 . . . . 0.0 112.041 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.66 115.36 1.22 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.968 0.907 . . . . 0.0 112.372 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.434 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 61.7 mtm180 57.17 33.82 23.89 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 124.283 1.033 . . . . 0.0 112.672 176.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.7 p -69.15 -23.21 63.93 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.491 -179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.512 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.5 p-10 -84.38 70.64 10.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 123.394 1.568 . . . . 0.0 110.0 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 59.5 pttt . . . . . 0 N--CA 1.418 -2.059 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.966 -176.401 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 CA--C 1.486 -1.51 0 CA-C-O 121.269 0.557 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.613 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 18.6 pttm -109.66 118.26 36.09 Favored 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 172.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.581 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 92.1 m -132.6 164.57 26.38 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.411 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 77.4 m-85 -82.66 86.74 6.79 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.46 -174.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.614 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 9.8 tt0 -84.62 -42.09 15.73 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.062 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.475 ' C ' ' H ' ' A' ' 8' ' ' LYS . 30.2 m170 -106.6 20.18 19.39 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.544 -178.129 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.05 14.91 Favored Glycine 0 CA--C 1.502 -0.734 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 -173.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.475 ' H ' ' C ' ' A' ' 6' ' ' HIS . 35.4 mtmm -105.2 155.84 18.67 Favored 'General case' 0 N--CA 1.416 -2.153 0 C-N-CA 125.055 1.342 . . . . 0.0 108.331 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.2 t -73.16 118.38 18.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 123.75 0.656 . . . . 0.0 111.049 -176.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.7 m -114.22 151.14 16.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.1 m -90.91 101.97 14.73 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.4 m -74.09 141.45 45.66 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.94 163.68 19.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 -173.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -55.58 -20.64 14.14 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -178.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.479 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.4 m-20 -72.3 -25.16 61.47 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.653 0.74 . . . . 0.0 109.551 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.443 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -87.53 101.02 13.21 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.638 -175.241 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -98.39 -12.73 21.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.646 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.31 122.14 27.38 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -175.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 63.2 m -87.51 128.14 35.24 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 173.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 43.4 p90 -110.33 157.9 19.01 Favored 'General case' 0 C--N 1.296 -1.742 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.681 -172.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 19.4 t-160 -134.29 101.9 5.17 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.475 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -93.97 96.31 9.61 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.352 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -85.05 -15.72 43.08 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.608 -173.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.22 -146.37 45.92 Favored Glycine 0 N--CA 1.43 -1.729 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.946 178.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 67.0 mtt -83.48 147.8 53.69 Favored Pre-proline 0 C--N 1.291 -1.937 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 175.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.93 113.01 3.09 Favored 'Trans proline' 0 C--O 1.247 0.975 0 C-N-CA 122.268 1.979 . . . . 0.0 111.723 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -104.18 144.07 32.08 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.111 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -86.59 129.43 34.87 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 69.52 -4.14 1.45 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 124.466 1.106 . . . . 0.0 112.178 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.9 tt -120.72 124.27 44.74 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -100.72 105.27 16.6 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tt -82.17 106.56 14.16 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 35.7 mm -115.24 98.8 7.35 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 CA-C-O 122.154 0.978 . . . . 0.0 112.478 -171.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.475 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 92.3 mt -111.79 66.85 0.64 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 170.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.614 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 27.9 mt-30 -99.94 115.0 28.65 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.135 178.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.17 -151.81 5.5 Favored Glycine 0 C--N 1.29 -1.977 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.225 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.443 ' HB3' ' HB3' ' A' ' 16' ' ' MET . 74.3 m -131.3 135.01 46.93 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 178.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 t -130.48 149.27 52.23 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -177.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.479 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 17.7 m -66.53 -50.3 63.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -117.31 155.33 29.71 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 37.9 t -79.52 138.86 37.66 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.091 0.472 . . . . 0.0 111.675 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.8 t -87.54 115.4 24.94 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 172.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -91.58 95.46 9.94 Favored 'General case' 0 C--N 1.285 -2.225 0 CA-C-O 122.085 0.945 . . . . 0.0 112.341 -173.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.1 t -159.6 155.56 26.45 Favored 'General case' 0 N--CA 1.414 -2.235 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.03 -30.8 70.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 -60.62 -36.15 77.91 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.107 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.402 ' OD1' ' HB2' ' A' ' 20' ' ' TYR . 7.4 t30 -113.31 115.03 27.51 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-O 121.489 0.662 . . . . 0.0 111.712 -174.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -87.31 153.05 21.77 Favored 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.5 m -133.71 136.07 44.42 Favored 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.1 p -139.77 155.84 47.08 Favored 'General case' 0 C--N 1.285 -2.233 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -121.27 27.64 8.24 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -174.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.0 m -122.08 153.16 39.02 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.782 -0.574 . . . . 0.0 109.527 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.613 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 4.9 m-20 -63.04 129.13 39.01 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 63.87 27.57 14.5 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.483 1.113 . . . . 0.0 112.22 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.439 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 27.1 p -75.26 -23.77 57.51 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.7 p-10 -88.26 72.38 9.04 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 123.151 1.453 . . . . 0.0 110.201 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.411 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 51.5 pttt . . . . . 0 C--N 1.284 -2.28 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.198 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.463 HD23 ' SG ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.628 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -109.28 116.99 32.93 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 120.835 0.35 . . . . 0.0 110.962 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.463 ' SG ' HD23 ' A' ' 1' ' ' LEU . 87.1 m -140.97 165.77 26.62 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.656 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.602 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 66.3 m-85 -82.93 82.91 7.99 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.306 -174.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -84.68 -41.84 15.89 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.689 0.757 . . . . 0.0 110.075 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -103.35 19.46 19.64 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 122.394 1.092 . . . . 0.0 108.267 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.39 -27.4 11.99 Favored Glycine 0 C--O 1.219 -0.819 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.442 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 12.7 mptt -105.16 162.53 13.31 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.0 t -69.72 106.92 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 O-C-N 123.816 0.697 . . . . 0.0 110.703 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.8 m -117.53 152.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.4 m -87.9 112.64 22.75 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.331 0.586 . . . . 0.0 110.112 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.5 153.39 31.38 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -70.89 166.63 20.73 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.189 0.449 . . . . 0.0 110.954 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -65.88 -10.58 39.66 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 39' ' ' SER . 13.7 m-20 -77.05 -31.61 56.32 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 176.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.0 101.48 5.26 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.928 -174.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -94.11 -22.62 18.37 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.667 -178.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -126.2 147.02 49.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.346 -175.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -108.08 144.92 34.78 Favored 'General case' 0 C--N 1.272 -2.764 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 172.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.485 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 54.5 p90 -128.93 149.56 50.74 Favored 'General case' 0 N--CA 1.422 -1.848 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.807 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 19.1 t-160 -126.72 102.36 7.03 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 174.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.456 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.3 t30 -104.38 112.25 25.22 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.4 p -69.19 -26.68 64.95 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 124.272 0.982 . . . . 0.0 113.004 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.37 -160.43 41.97 Favored Glycine 0 N--CA 1.428 -1.884 0 N-CA-C 109.921 -1.271 . . . . 0.0 109.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 99.1 mmm -98.79 138.36 20.68 Favored Pre-proline 0 C--N 1.288 -2.081 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.37 117.89 4.89 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.903 2.402 . . . . 0.0 113.28 -176.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -131.65 143.69 50.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -71.79 125.53 27.4 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 72.62 -3.29 2.39 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.22 1.408 . . . . 0.0 112.736 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.61 94.37 4.44 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-O 121.153 0.501 . . . . 0.0 110.672 -178.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -93.59 107.75 19.57 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 tp -77.03 105.52 8.16 Favored 'General case' 0 N--CA 1.424 -1.726 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.6 mm -86.85 97.52 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 121.791 0.805 . . . . 0.0 110.938 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.456 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 75.6 mt -111.53 63.99 0.62 Allowed 'General case' 0 N--CA 1.415 -2.181 0 CA-C-O 122.388 1.089 . . . . 0.0 108.872 172.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.1 112.64 25.38 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 113.884 -1.507 . . . . 0.0 107.505 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.8 -163.36 10.21 Favored Glycine 0 C--N 1.282 -2.425 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.983 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.6 m -125.83 142.44 51.51 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.0 t -133.93 154.31 51.17 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-O 121.191 0.519 . . . . 0.0 110.261 -177.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 5.5 m -71.02 -45.45 63.91 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.833 178.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.2 t -119.35 -171.36 2.1 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.3 t -128.52 134.87 48.78 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -90.27 101.08 13.8 Favored 'General case' 0 N--CA 1.426 -1.645 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 170.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.23 114.67 12.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.654 0.74 . . . . 0.0 112.949 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.473 ' CG2' ' HB3' ' A' ' 47' ' ' ASN . 2.3 t -164.93 169.59 16.29 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 114.385 -1.28 . . . . 0.0 107.937 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -86.76 -24.85 24.95 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -75.35 -47.81 25.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.473 ' HB3' ' CG2' ' A' ' 44' ' ' THR . 6.8 t30 -98.16 98.93 10.15 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.795 176.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.485 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 62.4 mttp -86.1 119.63 26.6 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.776 -177.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 56.8 m -102.84 131.74 49.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 21.3 p -139.46 156.07 47.18 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 3.3 p -126.89 33.44 4.94 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 13.4 m -119.5 157.78 27.61 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.1 124.58 22.0 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.682 0.277 . . . . 0.0 111.449 -176.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.7 mtm180 63.21 26.44 15.2 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 124.413 1.085 . . . . 0.0 111.756 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.7 p -72.76 -22.13 60.9 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -175.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -87.6 32.39 0.72 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.956 0.884 . . . . 0.0 111.716 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.602 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 N--CA 1.432 -1.338 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.352 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.48 HD11 ' SG ' ' A' ' 19' ' ' CYS . 25.1 mt . . . . . 0 CA--C 1.49 -1.34 0 CA-C-O 120.848 0.356 . . . . 0.0 111.668 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.426 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 23.5 pttm -109.16 107.57 17.9 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 173.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.613 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 76.5 m -135.25 165.94 24.27 Favored 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 -173.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.452 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 90.0 m-85 -79.66 74.01 6.35 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.491 0.662 . . . . 0.0 109.563 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.476 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 7.4 tt0 -84.59 -39.47 18.68 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.332 -177.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -106.08 19.67 20.16 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.755 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.86 -34.41 4.93 Favored Glycine 0 C--N 1.312 -0.777 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.411 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 38.2 mtmm -105.28 162.97 12.96 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.436 -0.882 . . . . 0.0 109.993 175.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.6 t -68.15 111.29 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 O-C-N 124.145 0.903 . . . . 0.0 108.791 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.476 ' CG2' ' HB3' ' A' ' 5' ' ' GLN . 34.1 m -130.85 152.27 37.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.8 m -76.9 112.63 13.71 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 121.383 0.611 . . . . 0.0 109.733 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.4 m -80.36 151.06 29.63 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.17 -0.923 . . . . 0.0 108.816 178.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.414 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 4.0 t-80 -61.95 162.43 9.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 122.924 0.49 . . . . 0.0 110.458 -174.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -69.27 -16.03 63.49 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -77.36 -23.67 50.8 Favored 'General case' 0 CA--C 1.496 -1.125 0 CA-C-O 121.531 0.681 . . . . 0.0 109.343 176.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.414 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.9 OUTLIER -78.45 101.37 7.27 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.513 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -90.11 -23.03 21.5 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.573 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -130.96 146.6 52.41 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.991 -172.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.48 ' SG ' HD11 ' A' ' 1' ' ' LEU . 32.0 m -110.67 130.63 55.52 Favored 'General case' 0 C--N 1.28 -2.427 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 172.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.4 p90 -119.45 162.08 19.45 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.767 -1.173 . . . . 0.0 113.587 -173.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -128.12 105.9 8.69 Favored 'General case' 0 N--CA 1.416 -2.17 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 169.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 34' ' ' LEU . 16.4 t-20 -97.75 123.18 41.58 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -178.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.8 p -91.35 120.83 32.55 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 120.989 0.424 . . . . 0.0 111.834 -175.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.96 -174.86 36.43 Favored Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 174.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 73.9 mtm -72.69 148.16 89.79 Favored Pre-proline 0 C--N 1.308 -1.197 0 CA-C-N 117.87 0.835 . . . . 0.0 109.609 177.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.24 110.31 1.97 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.183 1.922 . . . . 0.0 112.222 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.06 139.01 46.78 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -92.4 146.18 23.89 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.7 m120 66.85 7.42 5.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.154 0.982 . . . . 0.0 110.993 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.0 tp -147.9 88.47 1.68 Allowed 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -89.34 82.84 6.43 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.939 0.876 . . . . 0.0 109.968 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 pp -76.65 106.05 8.07 Favored 'General case' 0 N--CA 1.419 -2.005 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.3 tp -99.06 127.51 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.966 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.57 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 22' ' ' ASN . 80.3 mt -116.35 84.84 2.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -128.22 115.44 18.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.501 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.33 -177.97 19.64 Favored Glycine 0 N--CA 1.411 -2.978 0 N-CA-C 109.851 -1.299 . . . . 0.0 109.851 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 88.8 m -113.21 136.23 52.95 Favored 'General case' 0 C--N 1.275 -2.649 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.7 t -131.86 155.57 47.6 Favored 'General case' 0 C--N 1.293 -1.855 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.896 -174.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -84.16 -46.66 11.66 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 m -107.02 158.8 16.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 176.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 39.7 t -150.72 149.0 29.24 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 120.685 0.279 . . . . 0.0 110.887 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -119.8 92.46 3.79 Favored 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 170.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.07 110.07 1.7 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.04 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -139.19 -172.11 3.26 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-N 114.92 -1.037 . . . . 0.0 108.335 -177.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.16 -34.28 56.42 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 174.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -65.92 -57.91 6.78 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.129 -1.396 . . . . 0.0 109.995 178.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -110.56 109.79 20.25 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.179 0.514 . . . . 0.0 110.26 -177.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -101.88 121.96 43.1 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.613 -178.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 85.4 m -114.04 145.27 41.82 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-O 120.959 0.409 . . . . 0.0 111.493 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.9 p -139.67 154.81 47.6 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.426 ' C ' ' HG1' ' A' ' 52' ' ' THR . 38.6 m -128.47 70.31 1.37 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.699 0.761 . . . . 0.0 109.999 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.426 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 9.3 m -148.87 154.78 39.95 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.426 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 8.1 m-20 -63.91 126.08 26.49 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 -177.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 61.27 26.4 16.24 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.461 1.104 . . . . 0.0 112.595 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.426 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 30.1 p -71.64 -28.47 63.79 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.896 -0.721 . . . . 0.0 111.725 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.613 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.0 p-10 -90.85 69.44 6.45 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 122.704 1.24 . . . . 0.0 111.08 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.452 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.4 ptmt . . . . . 0 C--N 1.293 -1.884 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.095 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.421 ' HA ' ' OD1' ' A' ' 53' ' ' ASP . 28.9 mt . . . . . 0 CA--C 1.486 -1.507 0 CA-C-O 120.944 0.402 . . . . 0.0 111.514 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -110.63 113.3 25.8 Favored 'General case' 0 N--CA 1.414 -2.262 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.856 169.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 m -124.84 163.82 21.36 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -174.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.626 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 88.7 m-85 -80.12 94.0 5.91 Favored 'General case' 0 C--O 1.195 -1.791 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.497 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 9.2 tt0 -84.68 -38.86 19.27 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.901 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -106.59 7.8 30.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.871 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.95 -17.6 58.49 Favored Glycine 0 C--N 1.311 -0.839 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 -170.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -104.77 154.79 19.56 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 43.9 t -75.42 124.86 34.21 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 O-C-N 123.785 0.678 . . . . 0.0 110.04 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.9 m -130.37 152.37 37.36 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.9 m -79.31 119.27 22.12 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.6 m -76.97 163.38 26.77 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.342 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.549 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 7.4 t-80 -71.5 165.26 24.23 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.466 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 3.1 mmp_? -60.9 -21.53 63.44 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.385 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.85 -15.52 41.6 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 120.751 0.31 . . . . 0.0 111.042 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.549 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -76.79 103.5 6.78 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.664 0.745 . . . . 0.0 112.91 -173.198 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.15 -22.62 23.97 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.153 -178.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -134.77 151.88 51.31 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.937 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.8 m -96.99 129.46 44.45 Favored 'General case' 0 C--N 1.283 -2.317 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 169.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.8 p90 -108.52 147.71 31.33 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 118.908 -1.117 . . . . 0.0 110.387 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.514 ' CD2' ' HG2' ' A' ' 35' ' ' GLN . 21.1 t-160 -131.2 102.18 5.88 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 175.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.432 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -97.93 103.55 15.5 Favored 'General case' 0 C--N 1.29 -1.98 0 N-CA-C 106.382 -1.711 . . . . 0.0 106.382 179.175 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.0 p -77.99 170.18 17.03 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 114.394 -1.275 . . . . 0.0 112.271 -173.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -153.99 171.68 32.64 Favored Glycine 0 N--CA 1.418 -2.518 0 N-CA-C 108.969 -1.652 . . . . 0.0 108.969 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 89.8 mtp -84.3 149.18 54.7 Favored Pre-proline 0 C--N 1.297 -1.68 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.17 112.45 3.43 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 121.951 1.767 . . . . 0.0 111.304 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -114.95 146.39 41.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -45.36 107.59 0.1 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.466 0.707 . . . . 0.0 111.659 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 68.3 17.9 9.22 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.768 1.227 . . . . 0.0 112.181 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.9 tp -141.08 93.33 2.58 Favored 'General case' 0 N--CA 1.428 -1.568 0 CA-C-O 121.806 0.812 . . . . 0.0 111.909 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -96.66 109.8 22.36 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 103.374 -2.825 . . . . 0.0 103.374 170.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.34 106.38 6.84 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 121.65 0.738 . . . . 0.0 109.737 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 18.4 mm -108.84 106.28 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.801 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.188 -176.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.5 mt -123.89 65.98 1.04 Allowed 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.891 174.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.514 ' HG2' ' CD2' ' A' ' 21' ' ' HIS . 52.2 mt-30 -102.61 116.99 33.71 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.56 -164.94 11.05 Favored Glycine 0 C--N 1.286 -2.204 0 C-N-CA 118.802 -1.666 . . . . 0.0 112.76 -178.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 24.5 m -117.73 135.39 54.06 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 177.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.4 t -133.98 152.73 51.96 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.336 -177.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 t -83.99 -34.13 24.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 43.6 p -115.35 -174.89 2.59 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.1 t -135.98 130.06 33.05 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.116 0.484 . . . . 0.0 111.885 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.2 m -91.87 104.43 16.86 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 172.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.16 102.33 5.72 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.462 -176.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.2 p -144.79 176.79 9.18 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -92.28 -17.53 24.63 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.873 0.844 . . . . 0.0 110.271 175.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -77.01 -37.85 54.21 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.192 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -113.2 108.28 17.06 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.379 0.609 . . . . 0.0 110.62 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -88.96 153.36 21.09 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.585 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.8 p -146.21 124.07 11.98 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.6 p -139.46 155.6 47.47 Favored 'General case' 0 C--N 1.278 -2.534 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 68.4 m -107.16 28.26 8.23 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -174.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.456 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.8 m -108.69 147.48 31.86 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.421 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 15.5 m-20 -65.9 124.4 22.4 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.434 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 66.16 28.34 10.17 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.479 1.112 . . . . 0.0 112.691 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.456 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.2 p -89.25 -9.07 52.04 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.624 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -85.21 37.63 0.68 Allowed 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.677 -0.639 . . . . 0.0 111.373 -176.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.626 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.5 pttm . . . . . 0 C--N 1.307 -1.257 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.758 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.638 HD13 ' SG ' ' A' ' 19' ' ' CYS . 17.0 mt . . . . . 0 CA--C 1.479 -1.775 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -109.3 101.83 10.8 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 70.9 m -133.39 164.52 26.94 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.054 0.454 . . . . 0.0 111.516 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.473 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.8 m-85 -82.31 83.43 7.44 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.0 -176.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -84.82 -41.84 15.69 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 119.508 -0.877 . . . . 0.0 110.403 177.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -106.38 19.3 20.72 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.532 0.682 . . . . 0.0 110.644 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.97 -35.46 4.54 Favored Glycine 0 C--N 1.305 -1.155 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -97.95 162.86 13.03 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 31.9 t -72.1 113.74 9.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 O-C-N 123.985 0.803 . . . . 0.0 109.473 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.12 151.88 34.49 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 34.4 m -79.86 121.62 25.64 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.17 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.3 m -86.33 136.95 32.95 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -62.13 165.02 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.921 0.763 . . . . 0.0 111.798 -170.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -64.44 -11.7 36.02 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.7 m-20 -78.92 -22.07 46.37 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -96.05 102.93 14.79 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.317 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -94.92 -16.62 22.7 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.248 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -130.61 130.81 44.47 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.607 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.638 ' SG ' HD13 ' A' ' 1' ' ' LEU . 45.2 m -95.84 143.89 26.66 Favored 'General case' 0 C--N 1.283 -2.298 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 174.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.525 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 48.4 p90 -126.77 153.1 46.01 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.986 -177.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -136.15 114.48 11.64 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.809 176.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.408 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 0.2 OUTLIER -76.45 112.84 13.4 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 175.314 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.7 t -151.75 -168.25 3.02 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 145.75 -94.96 0.17 Allowed Glycine 0 N--CA 1.427 -1.951 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.0 mtm -97.44 153.87 38.21 Favored Pre-proline 0 C--N 1.276 -2.6 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -60.53 126.96 21.26 Favored 'Trans proline' 0 C--O 1.254 1.298 0 C-N-CA 121.668 1.578 . . . . 0.0 110.672 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -73.88 130.09 39.2 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.651 -177.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -129.57 119.55 23.82 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m120 70.95 17.26 6.32 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.385 1.074 . . . . 0.0 110.371 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 tp -140.26 80.78 1.78 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -85.71 66.57 9.71 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 122.164 0.983 . . . . 0.0 111.044 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.75 122.77 39.52 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.361 -1.291 . . . . 0.0 108.851 174.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.6 tp -119.21 105.95 18.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.287 0 CA-C-O 121.792 0.806 . . . . 0.0 108.992 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.408 ' HB2' ' CB ' ' A' ' 22' ' ' ASN . 6.2 mp -94.97 91.91 6.61 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.962 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -119.26 112.01 18.93 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 176.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.42 -160.51 8.64 Favored Glycine 0 C--N 1.29 -2.021 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.92 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.476 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 76.4 m -138.26 137.25 37.31 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.9 t -133.96 155.37 50.06 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.097 0.475 . . . . 0.0 111.435 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 21.5 m -70.76 -39.03 73.47 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.426 -0.807 . . . . 0.0 110.085 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -131.9 132.65 43.8 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.2 t -134.3 148.39 50.76 Favored 'General case' 0 C--N 1.294 -1.805 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.201 -173.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.9 m -98.68 100.17 11.36 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.12 110.84 1.97 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.062 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -148.21 176.65 10.06 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 -177.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -78.8 -29.27 44.8 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -71.32 -53.1 15.37 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.779 -1.1 . . . . 0.0 109.543 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -114.38 101.39 9.11 Favored 'General case' 0 N--CA 1.415 -2.182 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.525 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 60.3 tttm -82.86 108.02 15.9 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.673 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 34.0 m -100.13 128.12 46.26 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 p -140.19 156.15 46.63 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.637 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -115.96 34.99 4.67 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -174.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.1 m -136.59 156.3 48.75 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.055 -1.028 . . . . 0.0 111.237 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -48.31 122.62 5.5 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 124.904 1.282 . . . . 0.0 112.073 177.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 56.66 31.29 18.98 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.946 1.298 . . . . 0.0 113.409 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 31.9 p -77.25 -20.29 55.39 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.233 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.459 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 31.7 p-10 -89.91 67.06 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 122.925 1.345 . . . . 0.0 111.392 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.6 pttm . . . . . 0 N--CA 1.423 -1.8 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.57 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.4 HD13 ' SG ' ' A' ' 19' ' ' CYS . 31.0 mt . . . . . 0 CA--C 1.488 -1.43 0 CA-C-O 121.176 0.512 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 22.7 pttm -109.55 113.59 26.51 Favored 'General case' 0 N--CA 1.415 -2.18 0 CA-C-N 115.436 -0.802 . . . . 0.0 108.965 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.576 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 92.7 m -136.17 165.49 25.62 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.723 -174.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.537 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.6 m-85 -79.72 86.85 5.27 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.226 -174.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -85.09 -41.55 15.63 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.652 0.739 . . . . 0.0 111.389 177.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -106.49 -0.31 24.11 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.723 0.773 . . . . 0.0 111.052 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 121.68 -37.45 2.92 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 108.74 -1.744 . . . . 0.0 108.74 -175.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 19.1 ptpt -94.96 161.97 13.93 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.401 HG13 ' HB2' ' A' ' 2' ' ' LYS . 16.5 t -75.85 122.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.202 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.6 m -130.41 151.57 36.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 98.0 m -72.11 118.86 15.51 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.75 158.61 22.78 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.681 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 12.5 t-80 -61.07 159.63 11.41 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.55 0.74 . . . . 0.0 111.977 -173.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -51.77 -32.37 30.74 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.282 1.433 . . . . 0.0 111.984 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 39' ' ' SER . 10.1 m-20 -86.34 -14.17 44.34 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.163 0.506 . . . . 0.0 110.815 -174.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.681 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.5 OUTLIER -83.1 100.41 10.5 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.093 -176.31 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -97.55 -14.85 20.8 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.029 -177.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -131.36 147.85 52.61 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.485 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 57.4 m -107.38 145.97 32.23 Favored 'General case' 0 C--N 1.267 -2.981 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 174.054 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.446 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 47.7 p90 -130.83 147.48 52.49 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.715 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.2 t-160 -119.5 101.71 8.13 Favored 'General case' 0 C--N 1.273 -2.737 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 172.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.476 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 23.7 t-20 -105.67 135.03 47.83 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.0 t -141.53 175.78 9.41 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -176.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.48 -157.96 20.5 Favored Glycine 0 CA--C 1.498 -1.007 0 C-N-CA 120.121 -1.038 . . . . 0.0 111.996 -176.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.9 mtm -75.55 128.81 83.26 Favored Pre-proline 0 C--N 1.313 -1.021 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -67.31 104.89 0.95 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 121.926 1.751 . . . . 0.0 113.46 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -132.52 145.62 51.3 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 125.728 1.611 . . . . 0.0 106.993 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -55.2 116.9 3.06 Favored 'General case' 0 C--O 1.245 0.857 0 O-C-N 123.41 0.444 . . . . 0.0 110.826 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 81.33 -3.38 1.68 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.233 1.413 . . . . 0.0 113.592 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -87.93 84.72 6.96 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.8 pttt -106.38 87.61 2.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.476 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.7 tp -83.98 106.06 15.35 Favored 'General case' 0 N--CA 1.417 -2.11 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.8 mm -104.28 100.7 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.947 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.688 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.476 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 90.1 mt -120.7 63.8 0.85 Allowed 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.37 -1.287 . . . . 0.0 107.537 174.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -91.6 114.84 27.48 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.94 -160.96 8.94 Favored Glycine 0 C--N 1.291 -1.956 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.686 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 78.2 m -128.4 145.34 51.12 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 173.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -133.89 162.13 32.87 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 16.2 t -82.0 -22.67 36.41 Favored 'General case' 0 N--CA 1.417 -2.108 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.164 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.8 p -133.01 176.41 8.52 Favored 'General case' 0 N--CA 1.424 -1.739 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 10.8 t -112.53 115.54 28.8 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.466 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.5 m -77.89 97.08 5.16 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 172.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.65 86.92 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 124.555 1.142 . . . . 0.0 114.067 -172.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.466 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 30.5 p -147.99 163.59 36.4 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 176.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -90.44 -17.18 27.62 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.284 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -72.52 -44.23 62.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.815 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.466 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 7.8 t30 -98.97 95.55 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 174.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 66.7 mttm -80.87 110.61 16.57 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.3 -175.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.7 p -99.79 133.6 43.91 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 22.2 p -140.27 156.36 46.5 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.6 p -132.21 68.03 1.51 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 121.346 0.594 . . . . 0.0 111.583 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -149.02 156.71 42.65 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.415 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 12.2 m-20 -61.99 127.86 33.38 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.6 mtt180 61.71 26.12 15.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.885 0.874 . . . . 0.0 113.064 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.41 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 28.2 p -72.02 -28.79 63.6 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.532 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.2 p-10 -86.82 66.28 9.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.537 1.16 . . . . 0.0 111.403 -176.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.537 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 23.5 pttm . . . . . 0 C--N 1.296 -1.721 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.313 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 C--O 1.207 -1.147 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -109.27 119.64 40.11 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.541 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 93.2 m -140.93 164.59 29.86 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.53 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.595 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 86.6 m-85 -80.64 89.2 5.7 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.62 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.453 ' HG2' ' HA2' ' A' ' 36' ' ' GLY . 25.6 mt-30 -80.31 -43.1 21.81 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.021 -1.072 . . . . 0.0 112.164 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -106.95 14.47 26.46 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.756 0.789 . . . . 0.0 109.371 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.73 -9.67 70.89 Favored Glycine 0 N--CA 1.44 -1.066 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -173.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.1 mttm -105.84 152.4 23.29 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 176.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.5 t -76.65 106.45 6.58 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -119.19 152.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 120.654 0.264 . . . . 0.0 111.022 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.9 m -79.43 106.03 11.17 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-O 121.274 0.559 . . . . 0.0 110.773 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 m -86.34 133.96 33.76 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 173.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -70.26 174.56 5.45 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.129 0.268 . . . . 0.0 110.652 -173.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 57.9 mtm180 -75.75 -3.87 37.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.234 0.54 . . . . 0.0 111.719 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -76.03 -29.8 58.22 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -86.04 101.02 12.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.27 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -91.41 -17.31 25.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.723 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -135.14 130.37 35.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.151 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 60.0 m -94.32 145.18 24.93 Favored 'General case' 0 C--N 1.277 -2.574 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 172.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -127.86 155.98 43.29 Favored 'General case' 0 C--N 1.282 -2.34 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.999 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -138.44 102.32 4.59 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 177.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.442 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 27.9 t-20 -107.72 95.83 5.97 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 177.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 t -88.5 136.6 32.91 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.372 -171.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.76 135.96 23.85 Favored Glycine 0 N--CA 1.428 -1.867 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.774 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -62.65 155.7 68.09 Favored Pre-proline 0 C--N 1.315 -0.922 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.01 107.65 0.33 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 122.942 2.428 . . . . 0.0 113.322 179.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -132.33 143.69 50.04 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 174.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -71.24 115.65 10.64 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.406 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 71.98 -3.61 2.18 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.17 1.388 . . . . 0.0 113.499 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 36.1 tp -118.26 120.58 38.1 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.224 -0.591 . . . . 0.0 110.359 -177.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.34 89.19 2.48 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.022 0.915 . . . . 0.0 109.202 174.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.428 HD21 ' H ' ' A' ' 32' ' ' LEU . 2.0 pt? -76.35 106.11 7.79 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.412 HD11 ' O ' ' A' ' 22' ' ' ASN . 6.4 tp -121.05 118.89 57.7 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.114 -171.067 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.442 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 83.0 mt -115.42 98.43 6.73 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 177.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.41 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 3.8 pt20 -130.91 104.36 7.09 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-O 121.26 0.553 . . . . 0.0 110.223 -179.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.453 ' HA2' ' HG2' ' A' ' 5' ' ' GLN . . . -145.17 -144.46 4.14 Favored Glycine 0 N--CA 1.419 -2.48 0 C-N-CA 119.932 -1.127 . . . . 0.0 112.253 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.541 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 83.0 m -132.01 133.39 44.39 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.1 t -131.0 163.74 26.91 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-O 121.337 0.589 . . . . 0.0 109.643 -178.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.0 t -82.29 -15.16 53.93 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.366 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.2 m -141.16 164.53 30.0 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.0 t -97.43 129.29 44.66 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -78.45 105.67 9.87 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -78.53 114.23 17.25 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.717 -177.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.3 t -173.22 -174.61 1.06 Allowed 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.71 -42.55 13.28 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 118.46 0.573 . . . . 0.0 111.96 -175.14 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -79.5 -27.07 41.45 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -173.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.426 ' HB2' HD21 ' A' ' 22' ' ' ASN . 7.7 t30 -90.63 107.35 19.11 Favored 'General case' 0 CA--C 1.491 -1.314 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.361 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -91.43 145.04 24.96 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.3 p -132.39 136.2 46.64 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.47 0.653 . . . . 0.0 111.115 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.2 p -140.09 157.35 45.77 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.92 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 m -124.88 45.14 2.61 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.8 t -148.03 165.42 30.82 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.868 179.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.4 121.25 6.64 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 114.705 -1.134 . . . . 0.0 113.149 -176.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 45.9 mtm180 60.58 22.24 12.02 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 124.902 1.281 . . . . 0.0 113.579 175.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.9 p -71.21 -25.71 62.63 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -175.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -87.97 29.17 0.95 Allowed 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.113 0.482 . . . . 0.0 111.609 -174.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.554 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 C--O 1.254 1.331 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.238 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 24.6 mt . . . . . 0 CA--C 1.486 -1.516 0 CA-C-O 120.861 0.362 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -109.66 115.27 29.56 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.199 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.507 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 94.2 m -139.78 165.17 28.0 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.948 0.404 . . . . 0.0 111.887 -174.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.516 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 88.9 m-85 -75.33 87.11 2.53 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.347 -176.294 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -84.97 -41.73 15.59 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.825 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -102.41 -4.48 25.42 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.232 1.015 . . . . 0.0 109.215 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.2 -23.86 7.14 Favored Glycine 0 N--CA 1.429 -1.8 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -175.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.516 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 65.3 pttt -102.05 161.2 13.86 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.32 117.34 23.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.7 m -123.48 152.43 28.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 178.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.8 m -77.89 111.8 14.1 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.59 152.61 28.48 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -74.96 166.66 23.31 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 110.659 -0.126 . . . . 0.0 110.659 -173.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -53.02 -27.71 20.79 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.965 1.306 . . . . 0.0 112.623 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.523 ' O ' ' HA ' ' A' ' 39' ' ' SER . 6.6 m-20 -69.4 -31.14 69.32 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.475 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.1 OUTLIER -86.93 101.01 13.0 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.364 -175.209 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -110.94 -3.61 15.53 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.488 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.89 124.41 24.95 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 67.1 m -93.6 140.68 29.34 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.5 p90 -121.57 147.94 45.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 121.412 0.625 . . . . 0.0 111.71 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -135.66 101.44 4.78 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.475 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 19.5 t-20 -83.54 125.91 32.26 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 175.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 53.3 p -71.69 -13.8 61.84 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 123.744 0.652 . . . . 0.0 111.803 -174.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.4 -173.36 54.14 Favored Glycine 0 N--CA 1.423 -2.214 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.754 179.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 92.4 mtp -133.87 108.03 11.71 Favored Pre-proline 0 C--N 1.292 -1.909 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.89 108.48 1.92 Allowed 'Trans proline' 0 C--O 1.249 1.06 0 C-N-CA 122.577 2.185 . . . . 0.0 114.679 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -131.82 143.93 50.55 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 174.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -52.46 120.81 6.01 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.413 0.446 . . . . 0.0 112.133 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.0 m120 70.32 10.08 7.17 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.268 1.427 . . . . 0.0 112.931 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -113.75 88.31 2.82 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 175.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -85.82 83.48 7.82 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.9 tp -83.35 105.36 14.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.414 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.1 mm -125.23 121.13 59.95 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.014 178.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.475 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 48.6 mt -127.51 78.0 1.79 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -102.17 109.11 20.72 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.83 -158.76 7.85 Favored Glycine 0 C--N 1.292 -1.91 0 C-N-CA 119.895 -1.145 . . . . 0.0 112.539 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.507 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.3 m -132.07 139.64 48.59 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 176.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 t -132.25 161.02 34.49 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 120.874 0.369 . . . . 0.0 110.09 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.523 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 23.0 t -76.2 -33.81 59.27 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 t -137.29 151.12 48.33 Favored 'General case' 0 N--CA 1.417 -2.096 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 9.6 t -70.45 119.86 15.24 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 177.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.9 m -80.88 87.87 5.9 Favored 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.87 100.67 0.06 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.02 -172.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.498 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 3.7 p -142.53 159.48 42.16 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.693 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -84.23 -27.5 27.92 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -88.18 -0.49 57.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.552 0.691 . . . . 0.0 110.613 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.498 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.1 t30 -125.0 130.26 51.99 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.272 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -96.14 126.86 41.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.8 p -120.44 129.21 53.79 Favored 'General case' 0 C--N 1.283 -2.321 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -140.23 156.13 46.62 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.638 -177.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.3 p -110.09 27.31 9.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.6 m -119.98 150.54 40.36 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.56 136.25 55.36 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.501 -0.479 . . . . 0.0 109.986 -175.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 63.88 15.86 9.43 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.494 1.117 . . . . 0.0 113.007 177.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.415 ' C ' ' H ' ' A' ' 57' ' ' LYS . 30.1 p -73.28 -12.57 60.89 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.961 0.41 . . . . 0.0 111.749 -177.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -92.48 29.78 1.64 Allowed 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.819 1.295 . . . . 0.0 109.023 -174.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HG2' ' CE2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.415 -2.204 0 C-N-CA 127.924 2.489 . . . . 0.0 109.332 -177.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.553 HD11 ' SG ' ' A' ' 19' ' ' CYS . 25.2 mt . . . . . 0 CA--C 1.489 -1.396 0 CA-C-O 121.454 0.645 . . . . 0.0 112.248 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -110.15 117.81 34.69 Favored 'General case' 0 N--CA 1.414 -2.263 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 171.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.56 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 95.5 m -138.51 164.51 29.23 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 120.777 0.322 . . . . 0.0 111.104 -176.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -80.88 75.0 7.84 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.388 0.613 . . . . 0.0 110.742 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -80.27 -40.67 26.46 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.256 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -106.28 20.03 19.6 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-O 121.476 0.655 . . . . 0.0 109.875 -177.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.6 -39.16 3.03 Favored Glycine 0 CA--C 1.498 -1.013 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -91.3 150.33 21.35 Favored 'General case' 0 C--O 1.258 1.514 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 173.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.0 p -75.22 112.59 12.94 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.211 0 CA-C-O 121.611 0.72 . . . . 0.0 111.108 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -119.29 153.0 21.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.114 -175.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.4 m -78.75 116.17 18.92 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.427 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.4 m -80.09 158.26 26.47 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t-80 -65.76 162.87 17.8 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.249 0.477 . . . . 0.0 110.802 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -63.77 -12.25 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -79.54 -21.39 45.23 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.627 0.727 . . . . 0.0 109.365 177.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.2 mtt -86.28 101.43 13.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.85 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -93.67 -18.5 22.08 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.84 -177.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -131.85 150.84 52.03 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.693 -176.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.553 ' SG ' HD11 ' A' ' 1' ' ' LEU . 58.2 m -112.75 138.13 50.03 Favored 'General case' 0 C--N 1.276 -2.626 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 172.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -116.34 148.0 41.02 Favored 'General case' 0 C--N 1.297 -1.689 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.446 -175.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -124.57 101.93 7.37 Favored 'General case' 0 N--CA 1.413 -2.275 0 CA-C-N 113.904 -1.498 . . . . 0.0 106.977 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.455 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 47.3 t-20 -102.62 130.04 49.39 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 38.4 p -83.21 -11.37 57.91 Favored 'General case' 0 C--N 1.289 -2.041 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.45 -134.02 12.42 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.5 mmm -118.04 148.23 43.08 Favored Pre-proline 0 C--N 1.281 -2.396 0 N-CA-C 105.301 -2.111 . . . . 0.0 105.301 173.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -64.98 104.25 0.56 Allowed 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 120.94 1.093 . . . . 0.0 111.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -133.34 143.72 49.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.858 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 -99.29 149.8 22.76 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 66.1 t30 70.87 13.05 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.435 1.094 . . . . 0.0 110.451 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.5 tp -119.96 106.94 12.52 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.775 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -105.62 89.17 3.02 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.4 mt -122.04 130.02 52.92 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.7 mm -95.53 129.3 45.83 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 CA-C-O 121.455 0.645 . . . . 0.0 111.77 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.455 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 5.6 mp -120.17 68.91 0.85 Allowed 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.812 175.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -122.6 113.5 19.35 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.27 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.01 -159.28 8.01 Favored Glycine 0 C--N 1.285 -2.259 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 19' ' ' CYS . 85.8 m -125.92 148.88 49.1 Favored 'General case' 0 C--N 1.285 -2.201 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.3 t -133.6 148.59 51.59 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.199 0.523 . . . . 0.0 110.564 -174.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.0 t -81.43 -40.33 23.53 Favored 'General case' 0 N--CA 1.425 -1.705 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.148 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.1 p -139.98 96.78 3.12 Favored 'General case' 0 N--CA 1.426 -1.651 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 15.3 t -92.14 153.94 19.01 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.761 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.1 t -110.27 109.39 19.83 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -70.38 108.95 4.48 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.782 -177.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.2 p -127.12 -169.58 2.06 Favored 'General case' 0 C--N 1.288 -2.1 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -97.78 -15.6 20.23 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 174.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.91 -42.96 23.05 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.666 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.43 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 5.5 t30 -125.41 118.5 25.99 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.505 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -95.96 145.01 25.77 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 34.0 m -123.33 116.29 23.07 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.85 148.98 40.79 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.0 p -118.62 22.21 12.15 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.559 0.695 . . . . 0.0 111.279 -175.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.8 m -116.31 147.8 41.2 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -65.05 138.87 58.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.448 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 62.87 19.7 11.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.365 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.3 p -67.0 -35.59 80.28 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.56 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -87.22 56.05 3.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.803 1.287 . . . . 0.0 111.529 -176.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? . . . . . 0 C--N 1.301 -1.504 0 CA-C-N 114.232 -1.349 . . . . 0.0 110.417 -179.845 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 19.4 mt . . . . . 0 CA--C 1.487 -1.457 0 CA-C-O 121.286 0.565 . . . . 0.0 112.134 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -110.8 123.26 49.74 Favored 'General case' 0 N--CA 1.416 -2.129 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 170.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 m -133.33 162.0 32.99 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -176.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.476 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.3 m-85 -81.36 85.34 6.45 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -77.45 -43.16 33.34 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 120.952 0.406 . . . . 0.0 111.867 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -107.76 18.39 21.41 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.318 1.056 . . . . 0.0 109.203 174.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.79 -16.85 59.08 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -105.17 140.74 37.88 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.6 p -74.96 115.02 15.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 CA-C-O 122.007 0.908 . . . . 0.0 111.744 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.5 m -120.35 152.29 23.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.976 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.9 m -71.84 118.04 14.18 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.373 0.606 . . . . 0.0 109.564 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.3 m -79.31 157.13 27.77 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -68.17 161.41 27.1 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -64.55 -6.45 7.54 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -81.37 -31.39 33.36 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -72.02 101.96 2.85 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.806 -174.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -95.42 -17.08 21.82 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.904 -1.498 . . . . 0.0 109.88 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -135.02 148.0 49.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.4 m -98.06 137.99 36.04 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 170.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.514 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 52.5 p90 -116.34 142.84 46.32 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 118.474 -1.291 . . . . 0.0 111.767 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -115.34 122.57 46.28 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -112.81 126.21 55.19 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 29.6 p -92.88 79.99 4.66 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.696 0.76 . . . . 0.0 110.765 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.541 ' HA3' ' O ' ' A' ' 32' ' ' LEU . . . -71.74 131.67 19.0 Favored Glycine 0 N--CA 1.432 -1.603 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.734 -177.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -55.68 151.47 22.16 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 124.642 1.177 . . . . 0.0 111.66 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.2 110.67 3.05 Favored 'Trans proline' 0 C--O 1.253 1.265 0 C-N-CA 122.383 2.055 . . . . 0.0 112.209 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -114.67 144.01 44.11 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 175.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -62.19 110.31 1.58 Allowed 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.489 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.4 m120 72.73 19.28 4.01 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 125.019 1.328 . . . . 0.0 111.861 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.2 tt -144.6 93.56 2.43 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-O 121.939 0.876 . . . . 0.0 109.088 176.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -93.43 107.19 19.07 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.541 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 66.0 tp -76.84 106.12 8.31 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-O 121.938 0.875 . . . . 0.0 110.555 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.3 mm -124.36 112.99 34.56 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.929 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -86.65 -66.37 0.91 Allowed 'General case' 0 N--CA 1.425 -1.713 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.086 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 28.7 mt-30 40.84 90.39 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 O-C-N 124.684 1.24 . . . . 0.0 113.436 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.12 -154.94 6.27 Favored Glycine 0 C--N 1.288 -2.111 0 C-N-CA 119.274 -1.441 . . . . 0.0 111.744 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.5 m -116.57 137.94 51.79 Favored 'General case' 0 C--N 1.29 -2.006 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 t -134.35 154.69 51.2 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.104 0.478 . . . . 0.0 110.539 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -87.63 -12.8 44.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.355 0.598 . . . . 0.0 109.397 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.0 m -134.16 165.54 24.84 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.099 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 28.0 t -107.16 117.18 33.39 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 120.684 0.278 . . . . 0.0 110.945 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.412 ' HB3' ' ND2' ' A' ' 47' ' ' ASN . 46.4 t -82.44 117.16 22.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 173.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -94.55 57.81 2.28 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.847 1.308 . . . . 0.0 111.603 -175.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.2 p -108.29 172.28 6.93 Favored 'General case' 0 N--CA 1.413 -2.304 0 CA-C-N 114.181 -1.372 . . . . 0.0 107.929 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -87.88 -26.19 22.88 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.205 177.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -72.95 -39.62 66.05 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.412 ' ND2' ' HB3' ' A' ' 42' ' ' SER . 6.2 t30 -114.98 119.3 36.02 Favored 'General case' 0 N--CA 1.422 -1.836 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -107.47 149.27 28.13 Favored 'General case' 0 C--N 1.287 -2.124 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.8 p -122.53 145.37 48.39 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.5 p -140.49 149.19 42.2 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -122.4 71.55 1.02 Allowed 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 121.766 0.793 . . . . 0.0 109.932 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.476 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 6.9 m -149.33 151.49 34.23 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -67.42 131.95 46.68 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 65.12 21.97 12.24 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.706 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.476 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 27.7 p -73.87 -25.83 60.25 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.9 p-10 -88.24 50.84 2.05 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.276 1.036 . . . . 0.0 111.274 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.476 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 50.6 pttt . . . . . 0 C--N 1.306 -1.308 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.644 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.415 HD12 ' SG ' ' A' ' 19' ' ' CYS . 28.3 mt . . . . . 0 CA--C 1.49 -1.332 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -109.72 108.92 19.47 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.304 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.511 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 79.4 m -134.01 164.96 26.14 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.07 -173.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -84.07 81.43 8.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.417 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.464 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 9.3 tt0 -79.59 -41.62 26.72 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 121.732 0.777 . . . . 0.0 110.697 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -106.92 20.12 19.48 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 121.706 0.765 . . . . 0.0 109.871 -177.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 -24.82 14.55 Favored Glycine 0 CA--C 1.499 -0.968 0 N-CA-C 110.041 -1.223 . . . . 0.0 110.041 -176.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -105.07 158.91 16.24 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.58 121.09 22.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 O-C-N 123.634 0.584 . . . . 0.0 110.178 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.9 m -130.76 151.65 36.26 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.7 m -83.44 115.97 22.3 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.4 m -74.12 154.71 39.03 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -77.57 170.42 16.61 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 118.42 0.555 . . . . 0.0 109.792 -176.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -62.73 -25.33 68.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.187 0.595 . . . . 0.0 111.126 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -69.16 -30.78 69.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.489 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -82.89 105.29 13.78 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.591 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -94.95 -14.92 24.0 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.85 -178.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -131.21 145.35 51.89 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.34 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.415 ' SG ' HD12 ' A' ' 1' ' ' LEU . 62.3 m -109.8 133.16 53.46 Favored 'General case' 0 C--N 1.272 -2.776 0 N-CA-C 104.871 -2.27 . . . . 0.0 104.871 171.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.554 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 51.4 p90 -116.06 146.36 42.26 Favored 'General case' 0 N--CA 1.42 -1.943 0 C-N-CA 118.702 -1.199 . . . . 0.0 112.551 -177.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -124.83 102.3 7.49 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.108 -1.405 . . . . 0.0 107.639 177.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.406 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 3.3 t-20 -88.5 118.54 28.22 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 174.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.7 p -82.6 -22.11 34.92 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 123.808 0.693 . . . . 0.0 110.655 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.47 -146.75 49.11 Favored Glycine 0 N--CA 1.429 -1.807 0 N-CA-C 109.099 -1.6 . . . . 0.0 109.099 -176.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 26.5 mmt -116.82 154.88 49.57 Favored Pre-proline 0 C--N 1.279 -2.461 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 174.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -63.08 112.03 1.57 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 121.524 1.483 . . . . 0.0 110.91 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.437 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 34.4 m-85 -116.13 140.24 49.5 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.407 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -62.51 107.49 0.95 Allowed 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.908 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.9 m120 59.75 24.53 13.46 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.522 1.129 . . . . 0.0 111.167 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.77 113.02 14.19 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 121.328 0.585 . . . . 0.0 109.852 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -97.71 98.55 9.96 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -80.8 106.69 13.0 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 17.0 mm -117.32 118.26 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.915 0 CA-C-O 121.956 0.884 . . . . 0.0 113.312 -175.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.406 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 6.2 mp -123.05 77.53 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.291 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -99.27 116.22 30.94 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.023 -0.989 . . . . 0.0 108.689 175.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.464 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -144.8 -173.37 16.04 Favored Glycine 0 CA--C 1.479 -2.162 0 C-N-CA 119.65 -1.262 . . . . 0.0 111.803 -179.191 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.3 m -113.5 138.13 50.56 Favored 'General case' 0 C--N 1.287 -2.144 0 N-CA-C 106.329 -1.73 . . . . 0.0 106.329 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -132.5 153.24 51.11 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 t -83.91 -46.05 12.54 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -113.87 -177.03 3.03 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.3 t -140.47 129.57 23.53 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.4 m -91.3 100.28 13.11 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 167.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.93 117.55 7.76 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.751 0.786 . . . . 0.0 112.799 -171.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.487 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 1.4 p -149.63 170.21 19.2 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.127 177.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -97.77 -18.49 18.76 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.465 0.65 . . . . 0.0 109.634 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -83.5 -27.69 29.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.108 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.487 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -118.17 95.41 4.88 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 79.7 tttt -79.0 108.25 12.34 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.481 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 28.5 p -100.12 119.85 38.96 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.5 p -130.68 155.96 45.72 Favored 'General case' 0 C--N 1.275 -2.661 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -115.11 21.61 14.07 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -112.77 151.54 30.2 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -65.16 134.89 54.7 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 110.538 -0.171 . . . . 0.0 110.538 -176.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 58.77 23.25 10.98 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.485 1.116 . . . . 0.0 113.029 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.7 p -71.09 -19.5 62.45 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 121.183 0.516 . . . . 0.0 111.472 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.511 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.5 p-10 -90.23 69.41 7.13 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 122.544 1.164 . . . . 0.0 110.998 -178.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttp . . . . . 0 N--CA 1.428 -1.535 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.691 -179.3 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.424 HD12 ' SG ' ' A' ' 19' ' ' CYS . 18.5 mt . . . . . 0 CA--C 1.487 -1.462 0 CA-C-O 121.037 0.446 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -110.38 113.67 26.51 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 5.5 m -123.87 164.18 19.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -172.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.419 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 81.6 m-85 -84.87 84.02 7.85 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -71.7 -42.42 67.4 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.19 -1.004 . . . . 0.0 110.584 178.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -106.02 7.12 31.77 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.56 0.695 . . . . 0.0 109.704 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.38 -14.58 63.3 Favored Glycine 0 C--N 1.31 -0.876 0 N-CA-C 107.926 -2.07 . . . . 0.0 107.926 -170.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.2 mttm -104.96 150.75 24.65 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.3 t -73.23 122.2 25.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 123.744 0.653 . . . . 0.0 110.384 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.8 m -121.57 151.07 24.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -84.01 113.34 20.93 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.5 m -83.77 143.5 29.93 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -65.95 169.5 6.65 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.225 0.466 . . . . 0.0 110.759 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -63.81 -9.78 16.62 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 124.295 1.038 . . . . 0.0 113.09 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -82.73 -29.0 30.07 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.429 ' HA ' ' HA ' ' A' ' 39' ' ' SER . 1.3 mpt? -81.98 101.65 10.44 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.529 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.09 -6.61 31.34 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.566 -177.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -134.8 148.61 50.23 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.267 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.424 ' SG ' HD12 ' A' ' 1' ' ' LEU . 25.3 m -99.77 137.18 38.6 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 171.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -112.35 147.29 36.68 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 118.173 -1.411 . . . . 0.0 111.313 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.4 t-160 -126.7 101.57 6.68 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 114.515 -1.22 . . . . 0.0 107.823 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.509 HD21 ' HB2' ' A' ' 47' ' ' ASN . 25.2 t-20 -101.07 115.01 29.49 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 175.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.5 p -79.38 -27.86 41.9 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.094 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.38 -146.66 49.08 Favored Glycine 0 N--CA 1.427 -1.912 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.291 178.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 69.5 mtm -90.91 138.21 26.31 Favored Pre-proline 0 C--N 1.292 -1.892 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.9 123.96 9.31 Favored 'Trans proline' 0 C--O 1.252 1.185 0 C-N-CA 122.465 2.11 . . . . 0.0 110.851 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -123.84 143.33 50.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.328 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -71.05 114.43 9.09 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.698 -176.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 67.1 t30 66.33 26.51 10.26 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.9 1.28 . . . . 0.0 110.07 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -130.87 129.08 41.84 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -102.29 94.89 5.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.493 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.7 tp -78.17 109.58 12.4 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.197 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.6 mm -113.55 101.65 12.77 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.646 0 CA-C-O 121.347 0.594 . . . . 0.0 111.671 -176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.6 mp -109.64 61.48 0.6 Allowed 'General case' 0 C--N 1.306 -1.325 0 CA-C-O 122.269 1.033 . . . . 0.0 108.794 171.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -96.71 130.39 43.95 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.63 -160.41 8.76 Favored Glycine 0 C--N 1.278 -2.668 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.938 178.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 m -119.87 135.99 54.66 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.8 t -133.72 150.85 51.51 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.255 0.55 . . . . 0.0 110.82 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 16' ' ' MET . 13.1 t -77.17 -45.47 26.59 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.385 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.5 m -119.69 -175.79 3.03 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 43.2 t -125.46 138.69 54.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.003 0.43 . . . . 0.0 110.62 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.3 p -88.88 173.51 8.48 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 123.482 0.713 . . . . 0.0 110.652 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -91.92 17.73 8.83 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.112 0.482 . . . . 0.0 111.011 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.43 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 7.8 p -82.38 146.03 29.58 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.741 -175.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.08 -26.2 14.3 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -74.58 -27.16 60.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.509 ' HB2' HD21 ' A' ' 22' ' ' ASN . 8.9 t30 -115.81 96.75 5.75 Favored 'General case' 0 N--CA 1.416 -2.142 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 174.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -87.82 154.28 20.67 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.131 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 31.5 p -130.03 142.68 50.59 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 p -140.21 147.52 40.19 Favored 'General case' 0 C--N 1.278 -2.523 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 26.0 t -116.93 68.49 0.74 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.925 0.869 . . . . 0.0 110.968 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.0 m -148.78 144.99 27.37 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -69.54 130.59 42.87 Favored 'General case' 0 C--N 1.287 -2.129 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.499 -177.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.4 mtp-105 69.19 26.4 5.48 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.599 1.159 . . . . 0.0 111.524 -178.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.463 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 28.4 p -78.71 -26.37 44.83 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 178.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.424 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 32.3 p-10 -83.45 70.61 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.839 1.304 . . . . 0.0 110.044 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.47 ' HB2' ' HZ1' ' A' ' 57' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.428 -1.541 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.896 -172.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.431 HD12 ' SG ' ' A' ' 19' ' ' CYS . 19.5 mt . . . . . 0 CA--C 1.478 -1.807 0 CA-C-O 120.556 0.217 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 10.5 ptpp? -109.23 112.34 24.44 Favored 'General case' 0 N--CA 1.414 -2.238 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 174.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.549 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 74.0 m -136.26 165.06 26.64 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.197 -175.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.434 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 92.7 m-85 -82.02 63.0 6.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.415 0.626 . . . . 0.0 110.611 -176.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.453 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 8.2 tt0 -70.61 -31.99 69.17 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.927 -175.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -106.21 -7.36 17.9 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 122.155 0.979 . . . . 0.0 109.297 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.39 -18.07 30.61 Favored Glycine 0 C--N 1.305 -1.146 0 N-CA-C 108.099 -2.001 . . . . 0.0 108.099 -171.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 62.2 mttp -104.76 155.54 18.79 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.538 -1.331 . . . . 0.0 107.649 175.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.8 t -73.18 108.24 4.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 29.5 m -123.54 151.04 27.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 94.6 m -82.37 108.18 15.6 Favored 'General case' 0 N--CA 1.418 -2.073 0 CA-C-O 121.475 0.655 . . . . 0.0 109.524 176.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 58.3 m -76.7 136.94 39.11 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 176.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -57.21 162.35 2.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.568 0.747 . . . . 0.0 111.227 -172.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -62.33 -17.42 58.8 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -176.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.406 ' O ' ' HA ' ' A' ' 39' ' ' SER . 7.0 m-20 -71.01 -30.35 66.56 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.756 0.789 . . . . 0.0 109.117 176.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -79.03 101.41 7.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.451 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -91.92 -22.19 20.18 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.028 -178.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -127.42 137.31 52.69 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.479 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.431 ' SG ' HD12 ' A' ' 1' ' ' LEU . 60.2 m -103.49 127.82 50.81 Favored 'General case' 0 C--N 1.279 -2.468 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -109.57 159.73 16.84 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.767 -0.773 . . . . 0.0 111.948 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.415 ' NE2' ' HB ' ' A' ' 23' ' ' THR . 7.8 t-160 -129.99 101.46 5.85 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.859 177.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.505 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.0 t-20 -101.36 118.23 36.56 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.415 ' HB ' ' NE2' ' A' ' 21' ' ' HIS . 8.9 t -118.63 134.66 54.95 Favored 'General case' 0 C--N 1.287 -2.122 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.063 -177.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.37 171.88 48.33 Favored Glycine 0 N--CA 1.432 -1.578 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 176.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 64.4 mtt -75.9 147.04 80.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.83 106.08 0.6 Allowed 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 122.401 2.067 . . . . 0.0 112.892 -178.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -121.97 144.34 48.94 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -58.18 121.64 11.21 Favored 'General case' 0 C--O 1.242 0.709 0 O-C-N 123.402 0.439 . . . . 0.0 110.578 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 69.05 7.68 6.38 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.682 1.193 . . . . 0.0 112.502 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.6 tp -126.95 102.88 7.19 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.103 0.477 . . . . 0.0 110.654 -178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -110.64 98.98 8.02 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 tp -93.61 106.13 18.12 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.263 0.554 . . . . 0.0 109.58 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.4 mm -123.69 112.21 32.24 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.264 178.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.505 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.1 mt -119.83 70.55 0.86 Allowed 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 121.691 0.758 . . . . 0.0 109.203 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -86.06 118.73 25.71 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 173.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.453 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -139.53 -160.17 8.25 Favored Glycine 0 N--CA 1.425 -2.042 0 C-N-CA 120.002 -1.094 . . . . 0.0 112.506 -175.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.46 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 74.1 m -135.13 135.75 41.37 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 t -133.78 156.56 47.78 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 121.305 0.574 . . . . 0.0 110.836 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 18.2 m -76.59 -33.47 58.44 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.082 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.1 m -141.92 139.31 32.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.64 165.41 11.45 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.4 p -95.6 169.17 10.22 Favored 'General case' 0 N--CA 1.42 -1.94 0 C-N-CA 124.5 1.12 . . . . 0.0 110.566 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -93.34 27.93 2.4 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.612 0.72 . . . . 0.0 110.144 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.466 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.7 p -74.88 144.15 43.5 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.678 -178.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.39 -29.34 18.09 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -73.08 -44.34 60.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.102 176.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.466 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -93.15 99.17 11.8 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 176.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -89.29 151.61 22.01 Favored 'General case' 0 C--N 1.282 -2.327 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.5 -174.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.0 p -147.16 144.49 29.02 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.7 p -139.51 155.51 47.49 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 114.49 -1.232 . . . . 0.0 107.822 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -113.63 32.77 5.58 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.1 m -119.95 150.4 40.56 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -65.69 129.92 41.48 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.533 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 61.81 27.09 16.51 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.491 -1.232 . . . . 0.0 112.577 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 30.1 p -77.56 -25.14 49.8 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.446 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.549 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -83.59 73.8 10.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 122.947 1.356 . . . . 0.0 110.315 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.294 -1.832 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.271 -177.044 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.412 HD11 ' SG ' ' A' ' 19' ' ' CYS . 30.8 mt . . . . . 0 CA--C 1.488 -1.423 0 CA-C-O 121.203 0.525 . . . . 0.0 111.905 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.401 ' HB2' ' CG1' ' A' ' 9' ' ' VAL . 20.3 pttp -110.77 113.95 26.93 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.203 172.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.493 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 85.0 m -135.82 164.02 28.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.274 0.559 . . . . 0.0 112.212 -174.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -81.39 85.02 6.51 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 122.129 -0.357 . . . . 0.0 111.324 -174.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.526 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 10.0 tt0 -81.4 -43.2 19.31 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.754 -1.178 . . . . 0.0 112.103 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -107.0 19.35 20.57 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.578 0.704 . . . . 0.0 111.259 -178.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.13 -38.05 3.46 Favored Glycine 0 CA--C 1.497 -1.049 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 -176.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -100.5 163.44 12.36 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.401 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 41.0 t -72.86 132.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 O-C-N 123.557 0.536 . . . . 0.0 111.244 -176.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -126.41 152.09 33.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 174.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.45 120.46 29.84 Favored 'General case' 0 C--N 1.283 -2.317 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.947 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.4 m -80.47 143.88 33.01 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -74.07 169.35 17.68 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.11 -7.59 42.73 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.8 -29.64 56.08 Favored 'General case' 0 CA--C 1.495 -1.141 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -77.91 126.52 30.97 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.326 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -108.18 -24.92 11.32 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.156 -175.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -133.73 143.63 48.6 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.204 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.412 ' SG ' HD11 ' A' ' 1' ' ' LEU . 61.6 m -102.56 119.9 39.62 Favored 'General case' 0 C--N 1.278 -2.51 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 170.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.421 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.9 p90 -99.59 149.53 23.17 Favored 'General case' 0 N--CA 1.42 -1.926 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.811 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 -125.73 101.82 7.04 Favored 'General case' 0 C--N 1.278 -2.523 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.855 178.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -110.3 106.91 16.47 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 176.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.2 t -100.37 170.89 8.11 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.69 -165.17 29.32 Favored Glycine 0 C--N 1.3 -1.446 0 C-N-CA 119.738 -1.22 . . . . 0.0 111.047 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 86.1 mtp -74.06 133.48 78.53 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.4 104.47 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.902 1.735 . . . . 0.0 112.975 -176.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -133.21 143.67 49.3 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 114.865 -1.062 . . . . 0.0 108.444 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.488 ' HA ' ' NE ' ' A' ' 28' ' ' ARG . 2.0 mmp_? -70.79 129.82 40.09 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 73.69 17.05 3.75 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.652 1.181 . . . . 0.0 111.201 -176.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.79 91.58 3.59 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -104.04 105.14 15.22 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 68.0 tp -104.54 106.69 17.28 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 mm -103.66 103.39 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.094 0 CA-C-O 121.809 0.814 . . . . 0.0 111.147 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.2 mt -123.58 63.53 1.03 Allowed 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 170.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 21.3 mt-30 -109.5 114.95 29.01 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.974 -1.467 . . . . 0.0 107.247 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.55 -170.72 13.97 Favored Glycine 0 C--N 1.286 -2.209 0 C-N-CA 119.314 -1.422 . . . . 0.0 112.174 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 20.8 m -111.44 132.14 54.69 Favored 'General case' 0 C--N 1.285 -2.219 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -133.85 154.32 51.11 Favored 'General case' 0 C--N 1.302 -1.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.755 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -86.69 -11.3 51.63 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.358 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.5 m -141.47 -169.05 2.79 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.7 t -148.7 151.55 35.11 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.7 t -114.03 110.48 20.11 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 170.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -70.81 97.33 1.37 Allowed 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 122.825 1.298 . . . . 0.0 111.273 -176.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.9 p -135.91 178.15 7.28 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.962 -176.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -94.95 -28.21 15.28 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.344 0.592 . . . . 0.0 109.752 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -88.3 -36.6 16.58 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -102.76 106.08 16.63 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -94.07 153.67 18.02 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.146 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.2 m -132.31 124.84 29.61 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.6 p -129.59 147.11 51.35 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -114.48 25.67 10.84 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.5 m -114.05 147.02 39.4 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -66.87 133.04 49.26 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.4 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 66.19 18.77 11.02 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 124.83 1.252 . . . . 0.0 112.693 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.5 p -65.35 -31.87 73.22 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.101 0.477 . . . . 0.0 111.685 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.493 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 36.9 p-10 -83.87 47.51 1.31 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.175 0.988 . . . . 0.0 111.107 -176.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt . . . . . 0 C--O 1.249 1.054 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.011 178.884 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.471 HD11 ' SG ' ' A' ' 19' ' ' CYS . 33.9 mt . . . . . 0 CA--C 1.472 -2.048 0 CA-C-O 120.712 0.291 . . . . 0.0 110.915 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.43 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 23.3 pttm -109.04 106.68 16.72 Favored 'General case' 0 N--CA 1.411 -2.409 0 CA-C-O 121.615 0.722 . . . . 0.0 109.121 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 85.3 m -131.07 166.14 21.71 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.83 -174.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -77.37 74.3 3.93 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.41 ' HA ' ' HA2' ' A' ' 36' ' ' GLY . 1.0 OUTLIER -85.85 -42.04 14.47 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.669 0.747 . . . . 0.0 109.337 178.324 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -100.42 20.46 14.83 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 122.329 1.061 . . . . 0.0 108.939 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.54 -35.66 3.79 Favored Glycine 0 CA--C 1.496 -1.141 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -176.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -104.46 163.13 12.67 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.9 t -68.09 114.37 4.87 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 123.893 0.746 . . . . 0.0 109.043 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.8 m -128.85 151.98 36.38 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.445 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.7 m -76.3 106.27 7.82 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.0 m -79.49 144.62 33.82 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -63.68 167.77 5.51 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.331 0.652 . . . . 0.0 112.466 -170.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -55.53 -23.31 25.73 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 125.064 1.346 . . . . 0.0 112.595 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.404 ' O ' ' HA ' ' A' ' 39' ' ' SER . 15.7 m-20 -84.35 -26.62 28.31 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -175.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -74.32 101.67 4.12 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.25 -177.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -94.42 -22.83 18.05 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.01 -177.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -128.39 148.41 50.69 Favored 'General case' 0 N--CA 1.429 -1.525 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.369 -173.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.471 ' SG ' HD11 ' A' ' 1' ' ' LEU . 57.3 m -106.32 136.22 46.44 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 104.565 -2.383 . . . . 0.0 104.565 170.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.45 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 43.4 p90 -125.59 152.98 44.38 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.87 -174.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.7 t-160 -130.4 102.61 6.25 Favored 'General case' 0 N--CA 1.421 -1.904 0 CA-C-N 113.886 -1.506 . . . . 0.0 107.007 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.493 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 5.0 t30 -90.27 102.29 15.02 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.0 p -67.85 -43.34 79.71 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.228 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.34 -152.52 41.66 Favored Glycine 0 N--CA 1.424 -2.121 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -176.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.456 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.2 mpp? -85.13 142.36 38.31 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.66 114.92 3.29 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.098 1.866 . . . . 0.0 109.947 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 52.3 m-85 -117.47 140.66 49.31 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 121.567 0.698 . . . . 0.0 110.614 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -91.87 127.88 37.5 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.726 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 65.9 t30 68.75 22.39 7.39 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.357 1.063 . . . . 0.0 110.064 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.1 tp -143.52 135.07 26.25 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.63 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -110.06 99.5 8.58 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.097 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -81.1 106.12 12.85 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 176.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 23.0 mm -112.15 115.01 48.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 CA-C-O 121.637 0.732 . . . . 0.0 112.74 -174.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 81.8 mt -133.94 72.84 1.48 Allowed 'General case' 0 N--CA 1.423 -1.808 0 CA-C-N 113.72 -1.582 . . . . 0.0 107.436 172.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -112.89 110.0 19.8 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.935 -177.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.41 ' HA2' ' HA ' ' A' ' 5' ' ' GLN . . . -145.19 -154.34 6.12 Favored Glycine 0 C--N 1.295 -1.75 0 C-N-CA 119.707 -1.235 . . . . 0.0 112.582 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.1 m -126.96 136.16 51.88 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 175.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.2 t -122.34 144.25 49.13 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.557 0.694 . . . . 0.0 111.663 -173.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 15.9 m -86.14 -30.2 22.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.724 178.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.2 m -142.19 104.27 4.42 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.0 t -116.52 136.85 52.64 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.634 -167.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.4 m -96.45 105.55 17.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.63 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -66.46 104.95 1.35 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.598 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -137.8 175.05 9.94 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.86 -36.52 64.87 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -63.76 -59.91 3.97 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.073 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 8.0 t30 -106.45 105.01 14.84 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.271 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.45 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 39.2 ttpt -86.22 116.71 24.57 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.17 -178.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 20.7 m -104.75 132.55 50.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.2 p -139.92 155.6 47.09 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.4 p -126.62 72.71 1.35 Allowed 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.819 0.819 . . . . 0.0 111.73 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.45 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 4.6 m -149.35 151.29 33.87 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 175.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.43 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 11.3 m-20 -66.86 126.08 27.93 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -177.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 69.93 18.88 7.16 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.499 1.52 . . . . 0.0 112.689 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.45 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.5 p -70.4 -20.35 62.94 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -176.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 28.9 p-10 -89.52 33.77 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.553 0.692 . . . . 0.0 110.786 -177.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 C--N 1.314 -0.935 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.574 -179.266 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 21.5 mt . . . . . 0 CA--C 1.497 -1.09 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -110.91 116.18 30.79 Favored 'General case' 0 C--N 1.278 -2.518 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 169.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.5 m -133.78 165.22 25.48 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-O 121.125 0.488 . . . . 0.0 111.567 -172.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.557 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.6 m-85 -83.65 86.57 7.1 Favored 'General case' 0 C--O 1.189 -2.087 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 -174.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -76.88 -41.48 43.6 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.033 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -105.85 12.17 31.05 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.555 -177.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.77 -10.53 72.0 Favored Glycine 0 CA--C 1.517 0.217 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -171.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.531 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.3 mttt -105.51 153.29 21.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 28.0 t -76.93 108.89 10.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 O-C-N 123.316 0.385 . . . . 0.0 110.152 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.4 m -123.85 151.26 28.59 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.8 m -82.75 129.25 34.95 Favored 'General case' 0 C--N 1.285 -2.218 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -178.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 60.4 m -74.05 158.08 34.93 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.596 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 20.9 t-80 -70.71 165.53 22.79 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 -176.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -68.59 3.73 1.71 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -176.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.71 -12.75 15.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.552 0.692 . . . . 0.0 109.332 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.596 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -86.9 117.2 25.48 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.703 -172.033 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -104.57 -21.54 13.41 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.344 -1.298 . . . . 0.0 109.907 -177.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -128.86 150.0 50.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.84 -177.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 64.9 m -109.26 136.87 48.01 Favored 'General case' 0 C--N 1.276 -2.611 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -120.54 152.82 37.57 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.051 -176.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -134.68 101.87 5.09 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 47' ' ' ASN . 5.2 t30 -97.74 104.7 16.75 Favored 'General case' 0 CA--C 1.485 -1.532 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.3 p -66.14 -36.47 83.22 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 123.797 0.686 . . . . 0.0 112.131 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.63 -132.09 29.36 Favored Glycine 0 N--CA 1.427 -1.945 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.39 124.28 36.22 Favored Pre-proline 0 C--N 1.282 -2.334 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -79.07 120.02 4.46 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.545 2.164 . . . . 0.0 111.37 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -117.16 142.96 46.36 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -66.88 125.68 26.68 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.972 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 68.13 21.97 8.47 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.815 1.246 . . . . 0.0 111.586 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.7 tp -141.25 103.04 4.35 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.339 0.59 . . . . 0.0 111.092 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -83.75 98.25 9.58 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 tt -77.17 106.4 8.86 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 177.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 26.1 mm -104.57 111.26 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.743 -172.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.439 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 62.0 mt -126.28 59.33 1.34 Allowed 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.192 -1.367 . . . . 0.0 108.057 172.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -93.5 125.38 38.08 Favored 'General case' 0 N--CA 1.421 -1.898 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 176.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.4 -163.61 10.49 Favored Glycine 0 C--N 1.27 -3.124 0 C-N-CA 119.204 -1.475 . . . . 0.0 112.961 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 60.9 m -131.49 134.94 46.66 Favored 'General case' 0 C--N 1.286 -2.185 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 t -134.01 162.45 32.04 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.317 0.58 . . . . 0.0 110.217 -176.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -90.82 -15.73 29.53 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 177.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.4 m -132.7 -171.26 2.62 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.359 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.8 t -121.66 165.52 15.63 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.9 p -80.39 165.1 22.56 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 123.73 0.812 . . . . 0.0 112.007 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -85.83 -20.84 28.54 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.934 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 t -99.47 156.5 17.0 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.843 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -89.47 -15.61 32.69 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 123.972 0.795 . . . . 0.0 109.465 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -58.19 -32.12 67.95 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 122.618 1.199 . . . . 0.0 109.019 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 6.4 t30 -105.58 113.95 27.82 Favored 'General case' 0 N--CA 1.409 -2.502 0 CA-C-N 113.508 -1.678 . . . . 0.0 107.788 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -89.08 142.27 27.78 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.1 p -124.7 135.71 53.27 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.1 p -139.92 156.65 46.57 Favored 'General case' 0 C--N 1.269 -2.906 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 p -117.72 29.12 8.02 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -173.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.0 m -129.14 154.43 46.73 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.059 0.457 . . . . 0.0 110.985 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -50.98 124.51 11.48 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.06 0.944 . . . . 0.0 112.363 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 58.29 27.43 15.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.579 1.151 . . . . 0.0 113.68 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.2 p -76.59 -25.12 53.6 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -87.31 33.67 0.69 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -171.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.557 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 14.4 ptmm? . . . . . 0 C--N 1.302 -1.471 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.457 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.439 HD12 ' SG ' ' A' ' 19' ' ' CYS . 27.7 mt . . . . . 0 CA--C 1.479 -1.769 0 CA-C-O 121.574 0.702 . . . . 0.0 111.773 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 47.4 pttt -109.75 108.56 18.96 Favored 'General case' 0 C--N 1.28 -2.449 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.843 174.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.554 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 71.9 m -133.23 165.12 25.54 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.788 -173.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.432 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 91.8 m-85 -81.98 74.19 8.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.237 0.541 . . . . 0.0 110.623 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.485 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.2 tt0 -85.04 -35.83 21.63 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-O 121.444 0.64 . . . . 0.0 112.103 -177.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -105.81 9.44 32.91 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 122.26 1.029 . . . . 0.0 108.336 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 103.39 -38.33 3.28 Favored Glycine 0 CA--C 1.498 -1.009 0 N-CA-C 108.252 -1.939 . . . . 0.0 108.252 -174.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -93.05 162.81 13.89 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 113.925 -1.137 . . . . 0.0 108.217 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.405 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 57.6 t -71.77 123.2 25.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 16.5 m -120.48 152.12 23.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.67 103.02 15.54 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.7 m -82.43 142.06 32.25 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -69.66 170.88 9.95 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.4 mtm180 -76.32 -4.16 40.64 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -69.26 -31.62 70.27 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 171.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -82.14 101.32 10.35 Favored 'General case' 0 N--CA 1.422 -1.839 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.853 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -102.37 -8.27 21.32 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.278 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -134.71 136.11 42.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.257 -178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.439 ' SG ' HD12 ' A' ' 1' ' ' LEU . 82.9 m -101.69 136.41 41.57 Favored 'General case' 0 C--N 1.28 -2.447 0 N-CA-C 105.25 -2.129 . . . . 0.0 105.25 170.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.406 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 51.3 p90 -120.72 147.35 45.41 Favored 'General case' 0 C--N 1.293 -1.852 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.335 -176.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.451 ' NE2' ' HB ' ' A' ' 23' ' ' THR . 12.8 t-160 -120.21 102.31 8.41 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.477 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 6.3 t30 -104.64 102.82 12.4 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.451 ' HB ' ' NE2' ' A' ' 21' ' ' HIS . 9.9 t -102.04 -162.96 0.97 Allowed 'General case' 0 C--N 1.273 -2.72 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.32 -102.68 0.27 Allowed Glycine 0 N--CA 1.416 -2.66 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.1 mtt -128.38 157.84 73.37 Favored Pre-proline 0 C--N 1.285 -2.228 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.65 105.46 1.1 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.4 1.4 . . . . 0.0 110.224 176.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -91.21 143.69 26.4 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.115 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.67 118.0 20.35 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.115 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 66.32 18.91 10.99 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.921 0.888 . . . . 0.0 111.735 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.0 tp -145.67 132.14 19.73 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -117.53 106.35 13.05 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 66.3 tp -80.96 106.22 12.79 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 25.1 mm -115.24 96.52 4.68 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.142 -177.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 84.2 mt -106.77 61.32 0.63 Allowed 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 173.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.485 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 23.5 mt-30 -97.93 120.13 37.77 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.439 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -145.84 -163.3 10.19 Favored Glycine 0 C--N 1.284 -2.325 0 C-N-CA 119.813 -1.184 . . . . 0.0 112.636 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.0 m -122.17 137.68 54.74 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 173.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -133.68 157.43 45.83 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 t -81.37 -43.25 19.27 Favored 'General case' 0 N--CA 1.416 -2.127 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.0 p -105.58 178.85 4.44 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.9 t -120.52 126.65 50.89 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.491 0.186 . . . . 0.0 110.906 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.1 m -82.0 85.33 6.74 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.31 99.97 0.77 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.639 1.209 . . . . 0.0 113.023 -173.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -148.82 175.74 10.99 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-N 113.012 -1.904 . . . . 0.0 107.006 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -89.86 -32.55 16.84 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.052 0.454 . . . . 0.0 110.968 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -79.31 -36.91 38.86 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.807 0.337 . . . . 0.0 111.4 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -94.31 99.58 11.78 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 174.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -89.99 114.53 26.39 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.516 -174.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 32.0 p -104.2 136.02 44.59 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.38 176.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.7 p -139.54 155.6 47.41 Favored 'General case' 0 C--N 1.282 -2.361 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.997 -179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -112.3 25.83 11.15 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.7 m -116.36 148.53 40.53 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -66.02 126.05 27.38 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 120.734 0.302 . . . . 0.0 111.175 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 65.7 24.75 11.53 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 124.843 1.257 . . . . 0.0 112.396 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.1 p -70.92 -19.56 62.57 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.177 0.513 . . . . 0.0 111.863 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.554 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 36.4 p-10 -89.43 70.54 8.06 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 122.469 1.128 . . . . 0.0 110.522 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.432 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 22.0 pttp . . . . . 0 C--N 1.306 -1.32 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.971 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 34.7 mt . . . . . 0 CA--C 1.484 -1.564 0 CA-C-O 120.858 0.361 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -110.92 113.58 26.26 Favored 'General case' 0 N--CA 1.415 -2.186 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.6 m -128.5 164.22 23.26 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.439 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 89.9 m-85 -82.78 76.94 9.6 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 122.37 -0.206 . . . . 0.0 111.371 -177.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.542 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.6 tt0 -77.92 -42.37 33.37 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.509 0.671 . . . . 0.0 111.187 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -90.91 -2.26 57.75 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.06 -14.96 62.17 Favored Glycine 0 C--N 1.307 -1.079 0 N-CA-C 107.242 -2.343 . . . . 0.0 107.242 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.4 mttt -105.03 155.82 18.62 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.3 t -70.87 113.13 6.52 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.1 m -125.88 152.22 32.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 16.1 m -82.37 126.62 32.39 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-O 121.185 0.517 . . . . 0.0 110.227 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.9 m -82.74 153.63 25.19 Favored 'General case' 0 C--N 1.297 -1.707 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.407 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.8 t-80 -67.62 160.88 26.97 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -178.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -62.88 -12.55 25.72 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -176.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -81.89 -24.34 35.75 Favored 'General case' 0 CA--C 1.504 -0.818 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.407 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.3 OUTLIER -73.51 126.0 29.23 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.699 -172.909 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -113.19 -24.25 9.52 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.13 -175.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -130.43 148.56 52.26 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.074 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.9 m -96.26 142.52 28.32 Favored 'General case' 0 C--N 1.286 -2.153 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 169.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.427 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 45.5 p90 -123.17 154.53 38.57 Favored 'General case' 0 C--N 1.294 -1.811 0 C-N-CA 118.466 -1.293 . . . . 0.0 111.429 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -131.97 106.05 7.8 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 174.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.429 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 27.0 t-20 -97.08 133.29 41.94 Favored 'General case' 0 C--N 1.289 -2.058 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 175.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.65 -164.35 1.8 Allowed 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -163.97 -75.65 0.03 OUTLIER Glycine 0 CA--C 1.476 -2.378 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 178.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 88.0 mtp -137.55 157.56 73.55 Favored Pre-proline 0 C--N 1.274 -2.71 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 175.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.62 143.64 24.33 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.946 1.764 . . . . 0.0 109.536 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.406 ' CB ' ' HB3' ' A' ' 30' ' ' LEU . 83.6 m-85 -116.18 142.9 46.21 Favored 'General case' 0 C--N 1.281 -2.4 0 CA-C-O 121.303 0.573 . . . . 0.0 112.221 -178.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -65.98 104.64 1.16 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.204 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 71.31 19.43 5.34 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 124.564 1.145 . . . . 0.0 111.301 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB3' ' CB ' ' A' ' 27' ' ' PHE . 66.0 tp -126.89 105.16 8.44 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -81.83 92.44 6.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 tt -82.9 106.26 14.58 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 20.9 mm -124.01 96.78 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.614 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.91 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.429 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 10.1 mp -104.98 60.91 0.69 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 170.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.542 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 25.8 mt-30 -103.45 126.52 50.65 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.583 -1.189 . . . . 0.0 108.262 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.04 -158.14 7.52 Favored Glycine 0 C--N 1.265 -3.39 0 C-N-CA 119.713 -1.232 . . . . 0.0 111.227 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 27.0 m -128.32 134.52 48.91 Favored 'General case' 0 C--N 1.281 -2.383 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.0 t -133.6 157.26 46.18 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.299 0.571 . . . . 0.0 110.245 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -87.8 -15.77 35.97 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.015 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.8 t -141.35 174.15 10.81 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.7 t -113.95 148.95 36.0 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 t -92.0 161.44 14.79 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -90.93 -12.45 36.01 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.985 0.421 . . . . 0.0 110.91 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -79.37 144.02 34.55 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-O 121.013 0.435 . . . . 0.0 110.478 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -2.88 53.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.991 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -76.89 -17.44 58.94 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.686 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -120.93 104.66 9.99 Favored 'General case' 0 N--CA 1.428 -1.572 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 53.4 mtpt -84.64 125.44 32.48 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.381 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.1 m -110.85 134.62 52.38 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.5 p -139.99 144.08 36.81 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -113.89 49.25 1.0 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -138.55 147.19 42.79 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 106.136 -1.801 . . . . 0.0 106.136 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -66.95 136.37 55.24 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.058 -177.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 63.72 19.77 11.89 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.438 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.0 p -68.12 -26.99 66.07 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.971 0.415 . . . . 0.0 110.841 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.441 HD21 ' HB3' ' A' ' 35' ' ' GLN . 36.2 p-10 -82.81 55.14 2.93 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 122.934 1.349 . . . . 0.0 111.09 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt . . . . . 0 N--CA 1.43 -1.474 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.196 -179.508 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.539 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 35.9 mt . . . . . 0 CA--C 1.482 -1.665 0 CA-C-O 121.095 0.474 . . . . 0.0 111.635 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -109.93 112.51 24.57 Favored 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 172.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.539 ' SG ' ' HB3' ' A' ' 1' ' ' LEU . 3.6 m -129.63 163.99 24.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.025 0.44 . . . . 0.0 110.622 -170.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.527 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 93.1 m-85 -81.36 90.48 6.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -83.95 -42.78 15.91 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.189 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -106.48 14.69 26.86 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.587 0.708 . . . . 0.0 109.181 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.2 -16.41 61.36 Favored Glycine 0 C--N 1.31 -0.91 0 N-CA-C 108.634 -1.786 . . . . 0.0 108.634 -172.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 92.1 mttt -105.09 159.01 16.17 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 56.3 t -81.4 119.05 30.24 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 123.612 0.57 . . . . 0.0 110.366 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.2 m -118.74 151.66 20.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.1 m -85.06 110.7 19.13 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.194 0.521 . . . . 0.0 109.752 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.4 m -85.77 140.76 30.2 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.986 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.401 ' CG ' ' H ' ' A' ' 14' ' ' ARG . 20.6 t-80 -71.42 172.35 9.62 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.769 -171.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.401 ' H ' ' CG ' ' A' ' 13' ' ' HIS . 98.9 mtt180 -66.9 -10.55 49.82 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.506 1.122 . . . . 0.0 112.576 -177.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -73.94 -31.3 62.99 Favored 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 174.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -86.8 114.13 23.21 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.814 -175.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -102.45 -16.28 16.23 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.964 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -134.25 145.27 48.98 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.091 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.519 ' SG ' HD13 ' A' ' 1' ' ' LEU . 33.7 m -92.74 140.81 29.14 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 168.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.506 ' CD2' ' HB2' ' A' ' 38' ' ' SER . 47.8 p90 -127.08 145.26 50.8 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.222 -1.391 . . . . 0.0 111.959 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -120.99 101.14 7.48 Favored 'General case' 0 C--N 1.274 -2.695 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 172.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.473 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.4 t-20 -104.48 138.05 41.44 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.4 t -162.4 -172.49 3.19 Favored 'General case' 0 N--CA 1.402 -2.869 0 N-CA-C 106.056 -1.831 . . . . 0.0 106.056 -177.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -139.08 -142.83 4.33 Favored Glycine 0 CA--C 1.481 -2.078 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -178.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.2 mtt -87.39 156.7 53.75 Favored Pre-proline 0 C--N 1.289 -2.047 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.09 106.39 1.71 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 121.709 1.606 . . . . 0.0 111.372 176.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -107.43 138.24 43.99 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.3 mtp180 -60.04 123.81 18.27 Favored 'General case' 0 C--N 1.319 -0.731 0 O-C-N 123.124 0.265 . . . . 0.0 110.839 -177.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 69.75 4.99 4.99 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.757 1.223 . . . . 0.0 113.365 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.8 tp -120.2 88.82 3.01 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-O 121.575 0.702 . . . . 0.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -87.55 87.63 7.45 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.496 ' H ' HD22 ' A' ' 32' ' ' LEU . 2.2 pt? -82.17 113.1 19.77 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 121.658 0.742 . . . . 0.0 110.385 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.7 mm -123.51 111.86 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.604 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.473 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 91.0 mt -124.64 67.98 1.09 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.002 175.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -94.1 112.7 24.54 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.496 177.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.95 -158.15 7.52 Favored Glycine 0 C--N 1.283 -2.382 0 C-N-CA 120.104 -1.046 . . . . 0.0 110.927 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.7 m -123.87 134.34 53.59 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 175.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.506 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 45.7 t -112.37 144.59 41.56 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.263 0.554 . . . . 0.0 111.173 -173.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.8 m -86.46 -35.08 19.87 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 114.986 -1.007 . . . . 0.0 108.381 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.9 p -149.73 122.05 8.42 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.485 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.9 t -79.72 148.36 31.56 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.1 m -89.3 116.01 27.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 173.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -66.55 99.27 0.57 Allowed 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 122.241 1.019 . . . . 0.0 112.717 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.647 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.1 p -141.94 179.34 6.93 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.072 -179.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -94.95 -52.23 4.33 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.358 -178.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -76.76 -25.83 53.88 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.249 -173.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.647 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t30 -81.61 105.21 12.58 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 57.8 mtpt -88.3 120.32 29.55 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.736 -174.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.2 m -121.8 126.26 48.39 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -139.9 155.43 47.19 Favored 'General case' 0 C--N 1.284 -2.264 0 C-N-CA 121.28 -0.168 . . . . 0.0 110.71 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -104.75 32.91 3.84 Favored 'General case' 0 CA--C 1.558 1.254 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -173.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.2 p -130.47 147.26 52.14 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 121.733 -0.604 . . . . 0.0 111.421 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.456 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 75.2 m-20 -57.13 133.94 55.45 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.185 -177.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 78.6 mtm180 64.14 16.19 9.84 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 125.049 1.34 . . . . 0.0 114.031 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 25.6 p -75.96 -14.28 60.24 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.172 -0.611 . . . . 0.0 112.249 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -87.34 30.62 0.78 Allowed 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.641 -0.662 . . . . 0.0 111.454 -176.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.507 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 13.5 ptmm? . . . . . 0 C--O 1.254 1.319 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.511 HD13 ' SG ' ' A' ' 19' ' ' CYS . 19.1 mt . . . . . 0 CA--C 1.486 -1.484 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 36.2 pttt -109.93 110.43 21.38 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.183 172.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.512 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 72.9 m -136.9 164.34 28.56 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.984 -175.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 54' ' ' ARG . 82.7 m-85 -84.4 81.58 8.77 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -176.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.495 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.1 tt0 -84.74 -42.94 14.75 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.223 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -106.17 19.07 21.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 -177.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.48 -38.59 3.15 Favored Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.45 153.8 24.28 Favored 'General case' 0 N--CA 1.426 -1.639 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.2 t -69.73 111.58 3.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 13.0 m -111.31 152.04 13.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.7 m -89.12 117.38 28.07 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.4 m -74.35 156.38 37.15 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.117 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.664 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.9 t-80 -64.29 160.57 18.47 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.87 0.868 . . . . 0.0 110.695 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -53.17 -40.47 64.38 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.451 1.1 . . . . 0.0 109.522 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -79.86 -8.52 59.34 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.571 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.664 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.4 OUTLIER -92.37 101.38 13.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 121.717 0.77 . . . . 0.0 109.598 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -88.46 -19.49 26.42 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.17 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -135.05 155.46 50.71 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.511 ' SG ' HD13 ' A' ' 1' ' ' LEU . 86.3 m -113.47 145.78 40.63 Favored 'General case' 0 C--N 1.279 -2.486 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 171.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.1 p90 -124.61 150.59 45.81 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.421 -178.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 -127.24 111.94 14.53 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 177.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -102.27 105.85 16.56 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.496 ' O ' ' HA ' ' A' ' 46' ' ' ASN . 12.8 t -153.46 159.98 42.45 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.86 -51.73 0.7 Allowed Glycine 0 CA--C 1.467 -2.947 0 N-CA-C 108.099 -2.0 . . . . 0.0 108.099 -177.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 19.0 ptp -74.6 128.27 85.89 Favored Pre-proline 0 C--N 1.287 -2.149 0 CA-C-N 113.675 -1.262 . . . . 0.0 108.6 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -83.37 150.28 13.34 Favored 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 122.616 2.21 . . . . 0.0 111.783 -178.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -127.61 134.64 49.67 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.494 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -111.26 134.37 52.9 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.823 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.67 19.93 11.7 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.394 1.078 . . . . 0.0 111.562 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.7 tp -168.33 149.35 4.93 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 tptt -128.5 87.84 2.65 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 173.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -87.35 111.24 20.88 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.8 tp -122.67 99.29 6.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 CA-C-O 121.669 0.747 . . . . 0.0 109.625 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.1 mt -85.0 85.34 7.49 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.994 0.902 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.495 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 9.3 pt20 -116.59 107.73 15.08 Favored 'General case' 0 C--N 1.276 -2.602 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.393 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.22 -150.85 5.33 Favored Glycine 0 C--N 1.295 -1.7 0 C-N-CA 119.907 -1.14 . . . . 0.0 112.596 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.5 m -120.39 136.81 54.6 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.2 t -133.99 154.6 51.01 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 121.572 0.701 . . . . 0.0 111.229 -177.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.3 t -80.85 -20.99 41.12 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.491 177.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.1 p -127.64 170.21 12.92 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 120.763 0.316 . . . . 0.0 111.672 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 45.3 t -127.03 104.01 7.77 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 m -97.2 96.47 8.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -78.89 103.98 9.21 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.051 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.1 p -134.93 176.76 8.36 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -81.91 -28.82 32.64 Favored 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.0 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.496 ' HA ' ' O ' ' A' ' 23' ' ' THR . 7.8 t30 -81.95 -47.24 12.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -103.11 106.45 16.97 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 94.6 mttt -101.57 120.17 39.9 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.919 -177.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 p -110.24 130.49 55.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.268 0.556 . . . . 0.0 111.49 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.0 p -139.42 156.5 46.93 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.062 0.945 . . . . 0.0 110.566 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.7 m -118.41 28.77 8.14 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.6 p -111.77 153.28 26.75 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 121.542 -0.724 . . . . 0.0 112.041 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.66 115.36 1.22 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.968 0.907 . . . . 0.0 112.372 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.434 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 61.7 mtm180 57.17 33.82 23.89 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 124.283 1.033 . . . . 0.0 112.672 176.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.7 p -69.15 -23.21 63.93 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.491 -179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.512 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.5 p-10 -84.38 70.64 10.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 123.394 1.568 . . . . 0.0 110.0 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 59.5 pttt . . . . . 0 N--CA 1.418 -2.059 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.966 -176.401 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 CA--C 1.486 -1.51 0 CA-C-O 121.269 0.557 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.613 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 18.6 pttm -109.66 118.26 36.09 Favored 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 172.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.581 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 92.1 m -132.6 164.57 26.38 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.411 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 77.4 m-85 -82.66 86.74 6.79 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.46 -174.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.614 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 9.8 tt0 -84.62 -42.09 15.73 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.062 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.475 ' C ' ' H ' ' A' ' 8' ' ' LYS . 30.2 m170 -106.6 20.18 19.39 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.544 -178.129 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.05 14.91 Favored Glycine 0 CA--C 1.502 -0.734 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 -173.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.475 ' H ' ' C ' ' A' ' 6' ' ' HIS . 35.4 mtmm -105.2 155.84 18.67 Favored 'General case' 0 N--CA 1.416 -2.153 0 C-N-CA 125.055 1.342 . . . . 0.0 108.331 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.2 t -73.16 118.38 18.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 123.75 0.656 . . . . 0.0 111.049 -176.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.7 m -114.22 151.14 16.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.1 m -90.91 101.97 14.73 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.4 m -74.09 141.45 45.66 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.94 163.68 19.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 -173.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -55.58 -20.64 14.14 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -178.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.479 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.4 m-20 -72.3 -25.16 61.47 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.653 0.74 . . . . 0.0 109.551 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.443 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -87.53 101.02 13.21 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.638 -175.241 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -98.39 -12.73 21.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.646 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.31 122.14 27.38 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -175.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 63.2 m -87.51 128.14 35.24 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 173.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 43.4 p90 -110.33 157.9 19.01 Favored 'General case' 0 C--N 1.296 -1.742 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.681 -172.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 19.4 t-160 -134.29 101.9 5.17 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.475 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -93.97 96.31 9.61 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.352 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -85.05 -15.72 43.08 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.608 -173.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.22 -146.37 45.92 Favored Glycine 0 N--CA 1.43 -1.729 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.946 178.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 67.0 mtt -83.48 147.8 53.69 Favored Pre-proline 0 C--N 1.291 -1.937 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 175.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.93 113.01 3.09 Favored 'Trans proline' 0 C--O 1.247 0.975 0 C-N-CA 122.268 1.979 . . . . 0.0 111.723 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -104.18 144.07 32.08 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.111 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -86.59 129.43 34.87 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 69.52 -4.14 1.45 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 124.466 1.106 . . . . 0.0 112.178 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.9 tt -120.72 124.27 44.74 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -100.72 105.27 16.6 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tt -82.17 106.56 14.16 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 35.7 mm -115.24 98.8 7.35 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 CA-C-O 122.154 0.978 . . . . 0.0 112.478 -171.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.475 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 92.3 mt -111.79 66.85 0.64 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 170.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.614 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 27.9 mt-30 -99.94 115.0 28.65 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.135 178.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.17 -151.81 5.5 Favored Glycine 0 C--N 1.29 -1.977 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.225 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.443 ' HB3' ' HB3' ' A' ' 16' ' ' MET . 74.3 m -131.3 135.01 46.93 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 178.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 t -130.48 149.27 52.23 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -177.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.479 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 17.7 m -66.53 -50.3 63.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -117.31 155.33 29.71 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 37.9 t -79.52 138.86 37.66 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.091 0.472 . . . . 0.0 111.675 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.8 t -87.54 115.4 24.94 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 172.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -91.58 95.46 9.94 Favored 'General case' 0 C--N 1.285 -2.225 0 CA-C-O 122.085 0.945 . . . . 0.0 112.341 -173.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.1 t -159.6 155.56 26.45 Favored 'General case' 0 N--CA 1.414 -2.235 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.03 -30.8 70.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 -60.62 -36.15 77.91 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.107 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.402 ' OD1' ' HB2' ' A' ' 20' ' ' TYR . 7.4 t30 -113.31 115.03 27.51 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-O 121.489 0.662 . . . . 0.0 111.712 -174.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -87.31 153.05 21.77 Favored 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.5 m -133.71 136.07 44.42 Favored 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.1 p -139.77 155.84 47.08 Favored 'General case' 0 C--N 1.285 -2.233 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -121.27 27.64 8.24 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -174.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.0 m -122.08 153.16 39.02 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.782 -0.574 . . . . 0.0 109.527 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.613 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 4.9 m-20 -63.04 129.13 39.01 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 63.87 27.57 14.5 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.483 1.113 . . . . 0.0 112.22 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.439 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 27.1 p -75.26 -23.77 57.51 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.7 p-10 -88.26 72.38 9.04 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 123.151 1.453 . . . . 0.0 110.201 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.411 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 51.5 pttt . . . . . 0 C--N 1.284 -2.28 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.198 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.463 HD23 ' SG ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.628 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -109.28 116.99 32.93 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 120.835 0.35 . . . . 0.0 110.962 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.463 ' SG ' HD23 ' A' ' 1' ' ' LEU . 87.1 m -140.97 165.77 26.62 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.656 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.602 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 66.3 m-85 -82.93 82.91 7.99 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.306 -174.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -84.68 -41.84 15.89 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.689 0.757 . . . . 0.0 110.075 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -103.35 19.46 19.64 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 122.394 1.092 . . . . 0.0 108.267 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.39 -27.4 11.99 Favored Glycine 0 C--O 1.219 -0.819 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.442 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 12.7 mptt -105.16 162.53 13.31 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.0 t -69.72 106.92 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 O-C-N 123.816 0.697 . . . . 0.0 110.703 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.8 m -117.53 152.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.4 m -87.9 112.64 22.75 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.331 0.586 . . . . 0.0 110.112 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.5 153.39 31.38 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -70.89 166.63 20.73 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.189 0.449 . . . . 0.0 110.954 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -65.88 -10.58 39.66 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 39' ' ' SER . 13.7 m-20 -77.05 -31.61 56.32 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 176.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.0 101.48 5.26 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.928 -174.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -94.11 -22.62 18.37 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.667 -178.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -126.2 147.02 49.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.346 -175.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -108.08 144.92 34.78 Favored 'General case' 0 C--N 1.272 -2.764 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 172.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.485 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 54.5 p90 -128.93 149.56 50.74 Favored 'General case' 0 N--CA 1.422 -1.848 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.807 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 19.1 t-160 -126.72 102.36 7.03 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 174.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.456 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.3 t30 -104.38 112.25 25.22 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.4 p -69.19 -26.68 64.95 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 124.272 0.982 . . . . 0.0 113.004 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.37 -160.43 41.97 Favored Glycine 0 N--CA 1.428 -1.884 0 N-CA-C 109.921 -1.271 . . . . 0.0 109.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 99.1 mmm -98.79 138.36 20.68 Favored Pre-proline 0 C--N 1.288 -2.081 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.37 117.89 4.89 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.903 2.402 . . . . 0.0 113.28 -176.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -131.65 143.69 50.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -71.79 125.53 27.4 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 72.62 -3.29 2.39 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.22 1.408 . . . . 0.0 112.736 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.61 94.37 4.44 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-O 121.153 0.501 . . . . 0.0 110.672 -178.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -93.59 107.75 19.57 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 tp -77.03 105.52 8.16 Favored 'General case' 0 N--CA 1.424 -1.726 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.6 mm -86.85 97.52 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 121.791 0.805 . . . . 0.0 110.938 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.456 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 75.6 mt -111.53 63.99 0.62 Allowed 'General case' 0 N--CA 1.415 -2.181 0 CA-C-O 122.388 1.089 . . . . 0.0 108.872 172.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.1 112.64 25.38 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 113.884 -1.507 . . . . 0.0 107.505 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.8 -163.36 10.21 Favored Glycine 0 C--N 1.282 -2.425 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.983 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.6 m -125.83 142.44 51.51 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.0 t -133.93 154.31 51.17 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-O 121.191 0.519 . . . . 0.0 110.261 -177.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 5.5 m -71.02 -45.45 63.91 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.833 178.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.2 t -119.35 -171.36 2.1 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.3 t -128.52 134.87 48.78 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -90.27 101.08 13.8 Favored 'General case' 0 N--CA 1.426 -1.645 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 170.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.23 114.67 12.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.654 0.74 . . . . 0.0 112.949 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.473 ' CG2' ' HB3' ' A' ' 47' ' ' ASN . 2.3 t -164.93 169.59 16.29 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 114.385 -1.28 . . . . 0.0 107.937 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -86.76 -24.85 24.95 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -75.35 -47.81 25.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.473 ' HB3' ' CG2' ' A' ' 44' ' ' THR . 6.8 t30 -98.16 98.93 10.15 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.795 176.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.485 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 62.4 mttp -86.1 119.63 26.6 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.776 -177.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 56.8 m -102.84 131.74 49.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 21.3 p -139.46 156.07 47.18 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 3.3 p -126.89 33.44 4.94 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 13.4 m -119.5 157.78 27.61 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.1 124.58 22.0 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.682 0.277 . . . . 0.0 111.449 -176.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.7 mtm180 63.21 26.44 15.2 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 124.413 1.085 . . . . 0.0 111.756 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.7 p -72.76 -22.13 60.9 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -175.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -87.6 32.39 0.72 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.956 0.884 . . . . 0.0 111.716 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.602 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 N--CA 1.432 -1.338 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.352 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.48 HD11 ' SG ' ' A' ' 19' ' ' CYS . 25.1 mt . . . . . 0 CA--C 1.49 -1.34 0 CA-C-O 120.848 0.356 . . . . 0.0 111.668 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.426 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 23.5 pttm -109.16 107.57 17.9 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 173.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.613 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 76.5 m -135.25 165.94 24.27 Favored 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 -173.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.452 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 90.0 m-85 -79.66 74.01 6.35 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.491 0.662 . . . . 0.0 109.563 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.476 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 7.4 tt0 -84.59 -39.47 18.68 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.332 -177.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -106.08 19.67 20.16 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.755 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.86 -34.41 4.93 Favored Glycine 0 C--N 1.312 -0.777 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.411 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 38.2 mtmm -105.28 162.97 12.96 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.436 -0.882 . . . . 0.0 109.993 175.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.6 t -68.15 111.29 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 O-C-N 124.145 0.903 . . . . 0.0 108.791 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.476 ' CG2' ' HB3' ' A' ' 5' ' ' GLN . 34.1 m -130.85 152.27 37.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.8 m -76.9 112.63 13.71 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 121.383 0.611 . . . . 0.0 109.733 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.4 m -80.36 151.06 29.63 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.17 -0.923 . . . . 0.0 108.816 178.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.414 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 4.0 t-80 -61.95 162.43 9.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 122.924 0.49 . . . . 0.0 110.458 -174.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -69.27 -16.03 63.49 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -77.36 -23.67 50.8 Favored 'General case' 0 CA--C 1.496 -1.125 0 CA-C-O 121.531 0.681 . . . . 0.0 109.343 176.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.414 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.9 OUTLIER -78.45 101.37 7.27 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.513 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -90.11 -23.03 21.5 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.573 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -130.96 146.6 52.41 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.991 -172.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.48 ' SG ' HD11 ' A' ' 1' ' ' LEU . 32.0 m -110.67 130.63 55.52 Favored 'General case' 0 C--N 1.28 -2.427 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 172.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.4 p90 -119.45 162.08 19.45 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.767 -1.173 . . . . 0.0 113.587 -173.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -128.12 105.9 8.69 Favored 'General case' 0 N--CA 1.416 -2.17 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 169.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 34' ' ' LEU . 16.4 t-20 -97.75 123.18 41.58 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -178.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.8 p -91.35 120.83 32.55 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 120.989 0.424 . . . . 0.0 111.834 -175.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.96 -174.86 36.43 Favored Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 174.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 73.9 mtm -72.69 148.16 89.79 Favored Pre-proline 0 C--N 1.308 -1.197 0 CA-C-N 117.87 0.835 . . . . 0.0 109.609 177.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.24 110.31 1.97 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.183 1.922 . . . . 0.0 112.222 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.06 139.01 46.78 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -92.4 146.18 23.89 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.7 m120 66.85 7.42 5.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.154 0.982 . . . . 0.0 110.993 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.0 tp -147.9 88.47 1.68 Allowed 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -89.34 82.84 6.43 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.939 0.876 . . . . 0.0 109.968 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 pp -76.65 106.05 8.07 Favored 'General case' 0 N--CA 1.419 -2.005 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.3 tp -99.06 127.51 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.966 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.57 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 22' ' ' ASN . 80.3 mt -116.35 84.84 2.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -128.22 115.44 18.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.501 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.33 -177.97 19.64 Favored Glycine 0 N--CA 1.411 -2.978 0 N-CA-C 109.851 -1.299 . . . . 0.0 109.851 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 88.8 m -113.21 136.23 52.95 Favored 'General case' 0 C--N 1.275 -2.649 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.7 t -131.86 155.57 47.6 Favored 'General case' 0 C--N 1.293 -1.855 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.896 -174.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -84.16 -46.66 11.66 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 m -107.02 158.8 16.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 176.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 39.7 t -150.72 149.0 29.24 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 120.685 0.279 . . . . 0.0 110.887 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -119.8 92.46 3.79 Favored 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 170.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.07 110.07 1.7 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.04 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -139.19 -172.11 3.26 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-N 114.92 -1.037 . . . . 0.0 108.335 -177.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.16 -34.28 56.42 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 174.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -65.92 -57.91 6.78 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.129 -1.396 . . . . 0.0 109.995 178.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -110.56 109.79 20.25 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.179 0.514 . . . . 0.0 110.26 -177.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -101.88 121.96 43.1 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.613 -178.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 85.4 m -114.04 145.27 41.82 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-O 120.959 0.409 . . . . 0.0 111.493 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.9 p -139.67 154.81 47.6 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.426 ' C ' ' HG1' ' A' ' 52' ' ' THR . 38.6 m -128.47 70.31 1.37 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.699 0.761 . . . . 0.0 109.999 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.426 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 9.3 m -148.87 154.78 39.95 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.426 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 8.1 m-20 -63.91 126.08 26.49 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 -177.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 61.27 26.4 16.24 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.461 1.104 . . . . 0.0 112.595 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.426 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 30.1 p -71.64 -28.47 63.79 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.896 -0.721 . . . . 0.0 111.725 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.613 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.0 p-10 -90.85 69.44 6.45 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 122.704 1.24 . . . . 0.0 111.08 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.452 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.4 ptmt . . . . . 0 C--N 1.293 -1.884 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.095 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.421 ' HA ' ' OD1' ' A' ' 53' ' ' ASP . 28.9 mt . . . . . 0 CA--C 1.486 -1.507 0 CA-C-O 120.944 0.402 . . . . 0.0 111.514 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -110.63 113.3 25.8 Favored 'General case' 0 N--CA 1.414 -2.262 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.856 169.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 m -124.84 163.82 21.36 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -174.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.626 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 88.7 m-85 -80.12 94.0 5.91 Favored 'General case' 0 C--O 1.195 -1.791 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.497 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 9.2 tt0 -84.68 -38.86 19.27 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.901 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -106.59 7.8 30.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.871 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.95 -17.6 58.49 Favored Glycine 0 C--N 1.311 -0.839 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 -170.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -104.77 154.79 19.56 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 43.9 t -75.42 124.86 34.21 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 O-C-N 123.785 0.678 . . . . 0.0 110.04 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.9 m -130.37 152.37 37.36 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.9 m -79.31 119.27 22.12 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.6 m -76.97 163.38 26.77 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.342 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.549 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 7.4 t-80 -71.5 165.26 24.23 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.466 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 3.1 mmp_? -60.9 -21.53 63.44 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.385 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.85 -15.52 41.6 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 120.751 0.31 . . . . 0.0 111.042 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.549 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -76.79 103.5 6.78 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.664 0.745 . . . . 0.0 112.91 -173.198 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.15 -22.62 23.97 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.153 -178.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -134.77 151.88 51.31 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.937 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.8 m -96.99 129.46 44.45 Favored 'General case' 0 C--N 1.283 -2.317 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 169.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.8 p90 -108.52 147.71 31.33 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 118.908 -1.117 . . . . 0.0 110.387 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.514 ' CD2' ' HG2' ' A' ' 35' ' ' GLN . 21.1 t-160 -131.2 102.18 5.88 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 175.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.432 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -97.93 103.55 15.5 Favored 'General case' 0 C--N 1.29 -1.98 0 N-CA-C 106.382 -1.711 . . . . 0.0 106.382 179.175 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.0 p -77.99 170.18 17.03 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 114.394 -1.275 . . . . 0.0 112.271 -173.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -153.99 171.68 32.64 Favored Glycine 0 N--CA 1.418 -2.518 0 N-CA-C 108.969 -1.652 . . . . 0.0 108.969 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 89.8 mtp -84.3 149.18 54.7 Favored Pre-proline 0 C--N 1.297 -1.68 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.17 112.45 3.43 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 121.951 1.767 . . . . 0.0 111.304 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -114.95 146.39 41.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -45.36 107.59 0.1 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.466 0.707 . . . . 0.0 111.659 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 68.3 17.9 9.22 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.768 1.227 . . . . 0.0 112.181 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.9 tp -141.08 93.33 2.58 Favored 'General case' 0 N--CA 1.428 -1.568 0 CA-C-O 121.806 0.812 . . . . 0.0 111.909 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -96.66 109.8 22.36 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 103.374 -2.825 . . . . 0.0 103.374 170.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.34 106.38 6.84 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 121.65 0.738 . . . . 0.0 109.737 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 18.4 mm -108.84 106.28 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.801 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.188 -176.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.5 mt -123.89 65.98 1.04 Allowed 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.891 174.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.514 ' HG2' ' CD2' ' A' ' 21' ' ' HIS . 52.2 mt-30 -102.61 116.99 33.71 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.56 -164.94 11.05 Favored Glycine 0 C--N 1.286 -2.204 0 C-N-CA 118.802 -1.666 . . . . 0.0 112.76 -178.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 24.5 m -117.73 135.39 54.06 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 177.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.4 t -133.98 152.73 51.96 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.336 -177.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 t -83.99 -34.13 24.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 43.6 p -115.35 -174.89 2.59 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.1 t -135.98 130.06 33.05 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.116 0.484 . . . . 0.0 111.885 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.2 m -91.87 104.43 16.86 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 172.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.16 102.33 5.72 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.462 -176.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.2 p -144.79 176.79 9.18 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -92.28 -17.53 24.63 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.873 0.844 . . . . 0.0 110.271 175.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -77.01 -37.85 54.21 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.192 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -113.2 108.28 17.06 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.379 0.609 . . . . 0.0 110.62 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -88.96 153.36 21.09 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.585 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.8 p -146.21 124.07 11.98 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.6 p -139.46 155.6 47.47 Favored 'General case' 0 C--N 1.278 -2.534 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 68.4 m -107.16 28.26 8.23 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -174.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.456 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.8 m -108.69 147.48 31.86 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.421 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 15.5 m-20 -65.9 124.4 22.4 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.434 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 66.16 28.34 10.17 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.479 1.112 . . . . 0.0 112.691 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.456 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.2 p -89.25 -9.07 52.04 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.624 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -85.21 37.63 0.68 Allowed 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.677 -0.639 . . . . 0.0 111.373 -176.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.626 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.5 pttm . . . . . 0 C--N 1.307 -1.257 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.758 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.638 HD13 ' SG ' ' A' ' 19' ' ' CYS . 17.0 mt . . . . . 0 CA--C 1.479 -1.775 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -109.3 101.83 10.8 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 70.9 m -133.39 164.52 26.94 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.054 0.454 . . . . 0.0 111.516 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.473 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.8 m-85 -82.31 83.43 7.44 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.0 -176.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -84.82 -41.84 15.69 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 119.508 -0.877 . . . . 0.0 110.403 177.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -106.38 19.3 20.72 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.532 0.682 . . . . 0.0 110.644 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.97 -35.46 4.54 Favored Glycine 0 C--N 1.305 -1.155 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -97.95 162.86 13.03 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 31.9 t -72.1 113.74 9.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 O-C-N 123.985 0.803 . . . . 0.0 109.473 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.12 151.88 34.49 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 34.4 m -79.86 121.62 25.64 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.17 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.3 m -86.33 136.95 32.95 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -62.13 165.02 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.921 0.763 . . . . 0.0 111.798 -170.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -64.44 -11.7 36.02 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.7 m-20 -78.92 -22.07 46.37 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -96.05 102.93 14.79 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.317 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -94.92 -16.62 22.7 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.248 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -130.61 130.81 44.47 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.607 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.638 ' SG ' HD13 ' A' ' 1' ' ' LEU . 45.2 m -95.84 143.89 26.66 Favored 'General case' 0 C--N 1.283 -2.298 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 174.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.525 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 48.4 p90 -126.77 153.1 46.01 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.986 -177.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -136.15 114.48 11.64 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.809 176.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.408 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 0.2 OUTLIER -76.45 112.84 13.4 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 175.314 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.7 t -151.75 -168.25 3.02 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 145.75 -94.96 0.17 Allowed Glycine 0 N--CA 1.427 -1.951 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.0 mtm -97.44 153.87 38.21 Favored Pre-proline 0 C--N 1.276 -2.6 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -60.53 126.96 21.26 Favored 'Trans proline' 0 C--O 1.254 1.298 0 C-N-CA 121.668 1.578 . . . . 0.0 110.672 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -73.88 130.09 39.2 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.651 -177.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -129.57 119.55 23.82 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m120 70.95 17.26 6.32 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.385 1.074 . . . . 0.0 110.371 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 tp -140.26 80.78 1.78 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -85.71 66.57 9.71 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 122.164 0.983 . . . . 0.0 111.044 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.75 122.77 39.52 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.361 -1.291 . . . . 0.0 108.851 174.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.6 tp -119.21 105.95 18.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.287 0 CA-C-O 121.792 0.806 . . . . 0.0 108.992 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.408 ' HB2' ' CB ' ' A' ' 22' ' ' ASN . 6.2 mp -94.97 91.91 6.61 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.962 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -119.26 112.01 18.93 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 176.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.42 -160.51 8.64 Favored Glycine 0 C--N 1.29 -2.021 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.92 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.476 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 76.4 m -138.26 137.25 37.31 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.9 t -133.96 155.37 50.06 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.097 0.475 . . . . 0.0 111.435 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 21.5 m -70.76 -39.03 73.47 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.426 -0.807 . . . . 0.0 110.085 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -131.9 132.65 43.8 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.2 t -134.3 148.39 50.76 Favored 'General case' 0 C--N 1.294 -1.805 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.201 -173.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.9 m -98.68 100.17 11.36 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.12 110.84 1.97 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.062 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -148.21 176.65 10.06 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 -177.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -78.8 -29.27 44.8 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -71.32 -53.1 15.37 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.779 -1.1 . . . . 0.0 109.543 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -114.38 101.39 9.11 Favored 'General case' 0 N--CA 1.415 -2.182 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.525 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 60.3 tttm -82.86 108.02 15.9 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.673 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 34.0 m -100.13 128.12 46.26 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 p -140.19 156.15 46.63 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.637 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -115.96 34.99 4.67 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -174.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.1 m -136.59 156.3 48.75 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.055 -1.028 . . . . 0.0 111.237 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -48.31 122.62 5.5 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 124.904 1.282 . . . . 0.0 112.073 177.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 56.66 31.29 18.98 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.946 1.298 . . . . 0.0 113.409 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 31.9 p -77.25 -20.29 55.39 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.233 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.459 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 31.7 p-10 -89.91 67.06 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 122.925 1.345 . . . . 0.0 111.392 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.6 pttm . . . . . 0 N--CA 1.423 -1.8 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.57 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.4 HD13 ' SG ' ' A' ' 19' ' ' CYS . 31.0 mt . . . . . 0 CA--C 1.488 -1.43 0 CA-C-O 121.176 0.512 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 22.7 pttm -109.55 113.59 26.51 Favored 'General case' 0 N--CA 1.415 -2.18 0 CA-C-N 115.436 -0.802 . . . . 0.0 108.965 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.576 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 92.7 m -136.17 165.49 25.62 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.723 -174.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.537 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.6 m-85 -79.72 86.85 5.27 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.226 -174.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -85.09 -41.55 15.63 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.652 0.739 . . . . 0.0 111.389 177.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -106.49 -0.31 24.11 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.723 0.773 . . . . 0.0 111.052 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 121.68 -37.45 2.92 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 108.74 -1.744 . . . . 0.0 108.74 -175.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 19.1 ptpt -94.96 161.97 13.93 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.401 HG13 ' HB2' ' A' ' 2' ' ' LYS . 16.5 t -75.85 122.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.202 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.6 m -130.41 151.57 36.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 98.0 m -72.11 118.86 15.51 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.75 158.61 22.78 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.681 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 12.5 t-80 -61.07 159.63 11.41 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.55 0.74 . . . . 0.0 111.977 -173.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -51.77 -32.37 30.74 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.282 1.433 . . . . 0.0 111.984 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 39' ' ' SER . 10.1 m-20 -86.34 -14.17 44.34 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.163 0.506 . . . . 0.0 110.815 -174.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.681 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.5 OUTLIER -83.1 100.41 10.5 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.093 -176.31 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -97.55 -14.85 20.8 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.029 -177.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -131.36 147.85 52.61 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.485 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 57.4 m -107.38 145.97 32.23 Favored 'General case' 0 C--N 1.267 -2.981 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 174.054 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.446 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 47.7 p90 -130.83 147.48 52.49 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.715 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.2 t-160 -119.5 101.71 8.13 Favored 'General case' 0 C--N 1.273 -2.737 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 172.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.476 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 23.7 t-20 -105.67 135.03 47.83 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.0 t -141.53 175.78 9.41 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -176.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.48 -157.96 20.5 Favored Glycine 0 CA--C 1.498 -1.007 0 C-N-CA 120.121 -1.038 . . . . 0.0 111.996 -176.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.9 mtm -75.55 128.81 83.26 Favored Pre-proline 0 C--N 1.313 -1.021 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -67.31 104.89 0.95 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 121.926 1.751 . . . . 0.0 113.46 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -132.52 145.62 51.3 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 125.728 1.611 . . . . 0.0 106.993 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -55.2 116.9 3.06 Favored 'General case' 0 C--O 1.245 0.857 0 O-C-N 123.41 0.444 . . . . 0.0 110.826 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 81.33 -3.38 1.68 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.233 1.413 . . . . 0.0 113.592 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -87.93 84.72 6.96 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.8 pttt -106.38 87.61 2.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.476 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.7 tp -83.98 106.06 15.35 Favored 'General case' 0 N--CA 1.417 -2.11 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.8 mm -104.28 100.7 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.947 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.688 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.476 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 90.1 mt -120.7 63.8 0.85 Allowed 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.37 -1.287 . . . . 0.0 107.537 174.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -91.6 114.84 27.48 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.94 -160.96 8.94 Favored Glycine 0 C--N 1.291 -1.956 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.686 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 78.2 m -128.4 145.34 51.12 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 173.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -133.89 162.13 32.87 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 16.2 t -82.0 -22.67 36.41 Favored 'General case' 0 N--CA 1.417 -2.108 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.164 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.8 p -133.01 176.41 8.52 Favored 'General case' 0 N--CA 1.424 -1.739 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 10.8 t -112.53 115.54 28.8 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.466 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.5 m -77.89 97.08 5.16 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 172.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.65 86.92 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 124.555 1.142 . . . . 0.0 114.067 -172.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.466 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 30.5 p -147.99 163.59 36.4 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 176.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -90.44 -17.18 27.62 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.284 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -72.52 -44.23 62.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.815 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.466 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 7.8 t30 -98.97 95.55 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 174.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 66.7 mttm -80.87 110.61 16.57 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.3 -175.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.7 p -99.79 133.6 43.91 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 22.2 p -140.27 156.36 46.5 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.6 p -132.21 68.03 1.51 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 121.346 0.594 . . . . 0.0 111.583 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -149.02 156.71 42.65 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.415 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 12.2 m-20 -61.99 127.86 33.38 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.6 mtt180 61.71 26.12 15.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.885 0.874 . . . . 0.0 113.064 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.41 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 28.2 p -72.02 -28.79 63.6 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.532 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.2 p-10 -86.82 66.28 9.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.537 1.16 . . . . 0.0 111.403 -176.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.537 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 23.5 pttm . . . . . 0 C--N 1.296 -1.721 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.313 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 C--O 1.207 -1.147 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -109.27 119.64 40.11 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.541 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 93.2 m -140.93 164.59 29.86 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.53 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.595 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 86.6 m-85 -80.64 89.2 5.7 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.62 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.453 ' HG2' ' HA2' ' A' ' 36' ' ' GLY . 25.6 mt-30 -80.31 -43.1 21.81 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.021 -1.072 . . . . 0.0 112.164 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -106.95 14.47 26.46 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.756 0.789 . . . . 0.0 109.371 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.73 -9.67 70.89 Favored Glycine 0 N--CA 1.44 -1.066 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -173.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.1 mttm -105.84 152.4 23.29 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 176.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.5 t -76.65 106.45 6.58 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -119.19 152.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 120.654 0.264 . . . . 0.0 111.022 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.9 m -79.43 106.03 11.17 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-O 121.274 0.559 . . . . 0.0 110.773 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 m -86.34 133.96 33.76 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 173.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -70.26 174.56 5.45 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.129 0.268 . . . . 0.0 110.652 -173.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 57.9 mtm180 -75.75 -3.87 37.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.234 0.54 . . . . 0.0 111.719 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -76.03 -29.8 58.22 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -86.04 101.02 12.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.27 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -91.41 -17.31 25.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.723 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -135.14 130.37 35.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.151 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 60.0 m -94.32 145.18 24.93 Favored 'General case' 0 C--N 1.277 -2.574 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 172.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -127.86 155.98 43.29 Favored 'General case' 0 C--N 1.282 -2.34 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.999 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -138.44 102.32 4.59 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 177.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.442 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 27.9 t-20 -107.72 95.83 5.97 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 177.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 t -88.5 136.6 32.91 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.372 -171.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.76 135.96 23.85 Favored Glycine 0 N--CA 1.428 -1.867 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.774 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -62.65 155.7 68.09 Favored Pre-proline 0 C--N 1.315 -0.922 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.01 107.65 0.33 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 122.942 2.428 . . . . 0.0 113.322 179.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -132.33 143.69 50.04 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 174.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -71.24 115.65 10.64 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.406 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 71.98 -3.61 2.18 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.17 1.388 . . . . 0.0 113.499 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 36.1 tp -118.26 120.58 38.1 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.224 -0.591 . . . . 0.0 110.359 -177.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.34 89.19 2.48 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.022 0.915 . . . . 0.0 109.202 174.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.428 HD21 ' H ' ' A' ' 32' ' ' LEU . 2.0 pt? -76.35 106.11 7.79 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.412 HD11 ' O ' ' A' ' 22' ' ' ASN . 6.4 tp -121.05 118.89 57.7 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.114 -171.067 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.442 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 83.0 mt -115.42 98.43 6.73 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 177.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.41 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 3.8 pt20 -130.91 104.36 7.09 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-O 121.26 0.553 . . . . 0.0 110.223 -179.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.453 ' HA2' ' HG2' ' A' ' 5' ' ' GLN . . . -145.17 -144.46 4.14 Favored Glycine 0 N--CA 1.419 -2.48 0 C-N-CA 119.932 -1.127 . . . . 0.0 112.253 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.541 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 83.0 m -132.01 133.39 44.39 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.1 t -131.0 163.74 26.91 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-O 121.337 0.589 . . . . 0.0 109.643 -178.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.0 t -82.29 -15.16 53.93 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.366 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.2 m -141.16 164.53 30.0 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.0 t -97.43 129.29 44.66 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -78.45 105.67 9.87 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -78.53 114.23 17.25 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.717 -177.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.3 t -173.22 -174.61 1.06 Allowed 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.71 -42.55 13.28 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 118.46 0.573 . . . . 0.0 111.96 -175.14 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -79.5 -27.07 41.45 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -173.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.426 ' HB2' HD21 ' A' ' 22' ' ' ASN . 7.7 t30 -90.63 107.35 19.11 Favored 'General case' 0 CA--C 1.491 -1.314 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.361 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -91.43 145.04 24.96 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.3 p -132.39 136.2 46.64 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.47 0.653 . . . . 0.0 111.115 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.2 p -140.09 157.35 45.77 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.92 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 m -124.88 45.14 2.61 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.8 t -148.03 165.42 30.82 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.868 179.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.4 121.25 6.64 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 114.705 -1.134 . . . . 0.0 113.149 -176.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 45.9 mtm180 60.58 22.24 12.02 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 124.902 1.281 . . . . 0.0 113.579 175.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.9 p -71.21 -25.71 62.63 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -175.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -87.97 29.17 0.95 Allowed 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.113 0.482 . . . . 0.0 111.609 -174.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.554 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 C--O 1.254 1.331 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.238 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 24.6 mt . . . . . 0 CA--C 1.486 -1.516 0 CA-C-O 120.861 0.362 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -109.66 115.27 29.56 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.199 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.507 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 94.2 m -139.78 165.17 28.0 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.948 0.404 . . . . 0.0 111.887 -174.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.516 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 88.9 m-85 -75.33 87.11 2.53 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.347 -176.294 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -84.97 -41.73 15.59 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.825 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -102.41 -4.48 25.42 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.232 1.015 . . . . 0.0 109.215 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.2 -23.86 7.14 Favored Glycine 0 N--CA 1.429 -1.8 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -175.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.516 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 65.3 pttt -102.05 161.2 13.86 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.32 117.34 23.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.7 m -123.48 152.43 28.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 178.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.8 m -77.89 111.8 14.1 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.59 152.61 28.48 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -74.96 166.66 23.31 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 110.659 -0.126 . . . . 0.0 110.659 -173.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -53.02 -27.71 20.79 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.965 1.306 . . . . 0.0 112.623 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.523 ' O ' ' HA ' ' A' ' 39' ' ' SER . 6.6 m-20 -69.4 -31.14 69.32 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.475 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.1 OUTLIER -86.93 101.01 13.0 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.364 -175.209 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -110.94 -3.61 15.53 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.488 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.89 124.41 24.95 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 67.1 m -93.6 140.68 29.34 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.5 p90 -121.57 147.94 45.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 121.412 0.625 . . . . 0.0 111.71 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -135.66 101.44 4.78 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.475 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 19.5 t-20 -83.54 125.91 32.26 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 175.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 53.3 p -71.69 -13.8 61.84 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 123.744 0.652 . . . . 0.0 111.803 -174.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.4 -173.36 54.14 Favored Glycine 0 N--CA 1.423 -2.214 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.754 179.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 92.4 mtp -133.87 108.03 11.71 Favored Pre-proline 0 C--N 1.292 -1.909 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.89 108.48 1.92 Allowed 'Trans proline' 0 C--O 1.249 1.06 0 C-N-CA 122.577 2.185 . . . . 0.0 114.679 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -131.82 143.93 50.55 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 174.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -52.46 120.81 6.01 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.413 0.446 . . . . 0.0 112.133 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.0 m120 70.32 10.08 7.17 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.268 1.427 . . . . 0.0 112.931 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -113.75 88.31 2.82 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 175.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -85.82 83.48 7.82 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.9 tp -83.35 105.36 14.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.414 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.1 mm -125.23 121.13 59.95 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.014 178.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.475 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 48.6 mt -127.51 78.0 1.79 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -102.17 109.11 20.72 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.83 -158.76 7.85 Favored Glycine 0 C--N 1.292 -1.91 0 C-N-CA 119.895 -1.145 . . . . 0.0 112.539 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.507 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.3 m -132.07 139.64 48.59 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 176.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 t -132.25 161.02 34.49 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 120.874 0.369 . . . . 0.0 110.09 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.523 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 23.0 t -76.2 -33.81 59.27 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 t -137.29 151.12 48.33 Favored 'General case' 0 N--CA 1.417 -2.096 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 9.6 t -70.45 119.86 15.24 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 177.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.9 m -80.88 87.87 5.9 Favored 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.87 100.67 0.06 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.02 -172.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.498 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 3.7 p -142.53 159.48 42.16 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.693 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -84.23 -27.5 27.92 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -88.18 -0.49 57.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.552 0.691 . . . . 0.0 110.613 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.498 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.1 t30 -125.0 130.26 51.99 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.272 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -96.14 126.86 41.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.8 p -120.44 129.21 53.79 Favored 'General case' 0 C--N 1.283 -2.321 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -140.23 156.13 46.62 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.638 -177.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.3 p -110.09 27.31 9.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.6 m -119.98 150.54 40.36 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.56 136.25 55.36 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.501 -0.479 . . . . 0.0 109.986 -175.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 63.88 15.86 9.43 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.494 1.117 . . . . 0.0 113.007 177.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.415 ' C ' ' H ' ' A' ' 57' ' ' LYS . 30.1 p -73.28 -12.57 60.89 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.961 0.41 . . . . 0.0 111.749 -177.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -92.48 29.78 1.64 Allowed 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.819 1.295 . . . . 0.0 109.023 -174.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HG2' ' CE2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.415 -2.204 0 C-N-CA 127.924 2.489 . . . . 0.0 109.332 -177.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.559 HD13 ' SG ' ' A' ' 19' ' ' CYS . 25.2 mt . . . . . 0 CA--C 1.489 -1.396 0 CA-C-O 121.454 0.645 . . . . 0.0 112.248 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -110.15 117.81 34.69 Favored 'General case' 0 N--CA 1.414 -2.263 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 171.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.545 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 95.5 m -138.51 164.51 29.23 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 120.777 0.322 . . . . 0.0 111.104 -176.016 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -80.88 75.0 7.84 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.388 0.613 . . . . 0.0 110.742 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -80.27 -40.67 26.46 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.256 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -106.28 20.03 19.6 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-O 121.476 0.655 . . . . 0.0 109.875 -177.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.6 -39.16 3.03 Favored Glycine 0 CA--C 1.498 -1.013 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -91.3 150.33 21.35 Favored 'General case' 0 C--O 1.258 1.514 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 173.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.0 p -75.22 112.59 12.94 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.211 0 CA-C-O 121.611 0.72 . . . . 0.0 111.108 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -119.29 153.0 21.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.114 -175.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.4 m -78.75 116.17 18.92 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.427 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.4 m -80.09 158.26 26.47 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t-80 -65.76 162.87 17.8 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.249 0.477 . . . . 0.0 110.802 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -63.77 -12.25 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -79.54 -21.39 45.23 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.627 0.727 . . . . 0.0 109.365 177.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.2 mtt -86.28 101.43 13.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.85 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -93.67 -18.5 22.08 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.84 -177.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -131.85 150.84 52.03 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.693 -176.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.559 ' SG ' HD13 ' A' ' 1' ' ' LEU . 58.2 m -112.75 138.13 50.03 Favored 'General case' 0 C--N 1.276 -2.626 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 172.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -116.34 148.0 41.02 Favored 'General case' 0 C--N 1.297 -1.689 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.446 -175.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 37.9 t60 -124.57 101.93 7.37 Favored 'General case' 0 N--CA 1.413 -2.275 0 CA-C-N 113.904 -1.498 . . . . 0.0 106.977 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 47' ' ' ASN . 47.3 t-20 -102.62 130.04 49.39 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 38.4 p -83.21 -11.37 57.91 Favored 'General case' 0 C--N 1.289 -2.041 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.45 -134.02 12.42 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.5 mmm -118.04 148.23 43.08 Favored Pre-proline 0 C--N 1.281 -2.396 0 N-CA-C 105.301 -2.111 . . . . 0.0 105.301 173.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -64.98 104.25 0.56 Allowed 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 120.94 1.093 . . . . 0.0 111.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -133.34 143.72 49.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.858 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 -99.29 149.8 22.76 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 66.1 t30 70.87 13.05 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.435 1.094 . . . . 0.0 110.451 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.5 tp -119.96 106.94 12.52 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.775 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -105.62 89.17 3.02 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.4 mt -122.04 130.02 52.92 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.431 HD13 ' HA ' ' A' ' 33' ' ' ILE . 7.7 mm -95.53 129.3 45.83 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 CA-C-O 121.455 0.645 . . . . 0.0 111.77 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.465 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 5.6 mp -120.17 68.91 0.85 Allowed 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.812 175.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.46 ' HB3' HD22 ' A' ' 56' ' ' ASN . 93.5 mt-30 -122.6 113.5 19.35 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.27 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.01 -159.28 8.01 Favored Glycine 0 C--N 1.285 -2.259 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 19' ' ' CYS . 85.8 m -125.92 148.88 49.1 Favored 'General case' 0 C--N 1.285 -2.201 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.65 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.3 t -133.6 148.59 51.59 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.199 0.523 . . . . 0.0 110.564 -174.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.0 t -81.43 -40.33 23.53 Favored 'General case' 0 N--CA 1.425 -1.705 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.148 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.1 p -139.98 96.78 3.12 Favored 'General case' 0 N--CA 1.426 -1.651 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 15.3 t -92.14 153.94 19.01 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.761 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.1 t -110.27 109.39 19.83 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.46 ' HG3' ' HB2' ' A' ' 49' ' ' CYS . 2.5 mp0 -70.38 108.95 4.48 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.782 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.2 p -127.12 -169.58 2.06 Favored 'General case' 0 C--N 1.288 -2.1 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -97.78 -15.6 20.23 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 174.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.91 -42.96 23.05 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.666 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 5.5 t30 -125.41 118.5 25.99 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.505 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -95.96 145.01 25.77 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.46 ' HB2' ' HG3' ' A' ' 43' ' ' GLU . 34.0 m -123.33 116.29 23.07 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.85 148.98 40.79 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.0 p -118.62 22.21 12.15 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.559 0.695 . . . . 0.0 111.279 -175.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.8 m -116.31 147.8 41.2 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -65.05 138.87 58.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.448 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 62.87 19.7 11.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.365 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.3 p -67.0 -35.59 80.28 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.545 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -87.22 56.05 3.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.803 1.287 . . . . 0.0 111.529 -176.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? . . . . . 0 C--N 1.301 -1.504 0 CA-C-N 114.232 -1.349 . . . . 0.0 110.417 -179.845 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 1' ' ' LEU . 19.4 mt . . . . . 0 CA--C 1.487 -1.457 0 CA-C-O 121.286 0.565 . . . . 0.0 112.134 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -110.8 123.26 49.74 Favored 'General case' 0 N--CA 1.416 -2.129 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 170.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 m -133.33 162.0 32.99 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -176.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.486 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.3 m-85 -81.36 85.34 6.45 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.406 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 57.7 tt0 -77.45 -43.16 33.34 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 120.952 0.406 . . . . 0.0 111.867 -177.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -107.76 18.39 21.41 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.318 1.056 . . . . 0.0 109.203 174.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.79 -16.85 59.08 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -105.17 140.74 37.88 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.423 HG21 ' HG2' ' A' ' 54' ' ' ARG . 5.6 p -74.96 115.02 15.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 CA-C-O 122.007 0.908 . . . . 0.0 111.744 -178.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.5 m -120.35 152.29 23.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.976 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.9 m -71.84 118.04 14.18 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.373 0.606 . . . . 0.0 109.564 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.3 m -79.31 157.13 27.77 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -68.17 161.41 27.1 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -64.55 -6.45 7.54 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -81.37 -31.39 33.36 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -72.02 101.96 2.85 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.806 -174.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -95.42 -17.08 21.82 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.904 -1.498 . . . . 0.0 109.88 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -135.02 148.0 49.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.4 m -98.06 137.99 36.04 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 170.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.522 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 52.5 p90 -116.34 142.84 46.32 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 118.474 -1.291 . . . . 0.0 111.767 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -115.34 122.57 46.28 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -112.81 126.21 55.19 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 29.6 p -92.88 79.99 4.66 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.696 0.76 . . . . 0.0 110.765 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 32' ' ' LEU . . . -71.74 131.67 19.0 Favored Glycine 0 N--CA 1.432 -1.603 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.734 -177.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -55.68 151.47 22.16 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 124.642 1.177 . . . . 0.0 111.66 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.2 110.67 3.05 Favored 'Trans proline' 0 C--O 1.253 1.265 0 C-N-CA 122.383 2.055 . . . . 0.0 112.209 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -114.67 144.01 44.11 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 175.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -62.19 110.31 1.58 Allowed 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.489 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.4 m120 72.73 19.28 4.01 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 125.019 1.328 . . . . 0.0 111.861 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.2 tt -144.6 93.56 2.43 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-O 121.939 0.876 . . . . 0.0 109.088 176.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -93.43 107.19 19.07 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.526 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 66.0 tp -76.84 106.12 8.31 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-O 121.938 0.875 . . . . 0.0 110.555 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' A' ' 33' ' ' ILE . 10.3 mm -124.36 112.99 34.56 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.929 173.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -86.65 -66.37 0.91 Allowed 'General case' 0 N--CA 1.425 -1.713 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.086 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.522 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 28.7 mt-30 40.84 90.39 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 O-C-N 124.684 1.24 . . . . 0.0 113.436 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.12 -154.94 6.27 Favored Glycine 0 C--N 1.288 -2.111 0 C-N-CA 119.274 -1.441 . . . . 0.0 111.744 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.5 m -116.57 137.94 51.79 Favored 'General case' 0 C--N 1.29 -2.006 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 t -134.35 154.69 51.2 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.104 0.478 . . . . 0.0 110.539 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -87.63 -12.8 44.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.355 0.598 . . . . 0.0 109.397 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.0 m -134.16 165.54 24.84 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.099 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 28.0 t -107.16 117.18 33.39 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 120.684 0.278 . . . . 0.0 110.945 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.4 t -82.44 117.16 22.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 173.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -94.55 57.81 2.28 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.847 1.308 . . . . 0.0 111.603 -175.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.2 p -108.29 172.28 6.93 Favored 'General case' 0 N--CA 1.413 -2.304 0 CA-C-N 114.181 -1.372 . . . . 0.0 107.929 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -87.88 -26.19 22.88 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.205 177.158 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -72.95 -39.62 66.05 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -114.98 119.3 36.02 Favored 'General case' 0 N--CA 1.422 -1.836 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -107.47 149.27 28.13 Favored 'General case' 0 C--N 1.287 -2.124 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.8 p -122.53 145.37 48.39 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.5 p -140.49 149.19 42.2 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -122.4 71.55 1.02 Allowed 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 121.766 0.793 . . . . 0.0 109.932 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.503 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 6.9 m -149.33 151.49 34.23 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -67.42 131.95 46.68 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.423 ' HG2' HG21 ' A' ' 9' ' ' VAL . 49.9 mtm180 65.12 21.97 12.24 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.706 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 27.7 p -73.87 -25.83 60.25 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.9 p-10 -88.24 50.84 2.05 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.276 1.036 . . . . 0.0 111.274 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.486 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 50.6 pttt . . . . . 0 C--N 1.306 -1.308 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.644 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.411 HD13 ' SG ' ' A' ' 19' ' ' CYS . 28.3 mt . . . . . 0 CA--C 1.49 -1.332 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -109.72 108.92 19.47 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.304 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.513 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 79.4 m -134.01 164.96 26.14 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.07 -173.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -84.07 81.43 8.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.417 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 57.9 tt0 -79.59 -41.62 26.72 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 121.732 0.777 . . . . 0.0 110.697 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -106.92 20.12 19.48 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 121.706 0.765 . . . . 0.0 109.871 -177.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 -24.82 14.55 Favored Glycine 0 CA--C 1.499 -0.968 0 N-CA-C 110.041 -1.223 . . . . 0.0 110.041 -176.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -105.07 158.91 16.24 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.58 121.09 22.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 O-C-N 123.634 0.584 . . . . 0.0 110.178 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.9 m -130.76 151.65 36.26 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.7 m -83.44 115.97 22.3 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.4 m -74.12 154.71 39.03 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -77.57 170.42 16.61 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 118.42 0.555 . . . . 0.0 109.792 -176.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -62.73 -25.33 68.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.187 0.595 . . . . 0.0 111.126 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -69.16 -30.78 69.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.489 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -82.89 105.29 13.78 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.591 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -94.95 -14.92 24.0 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.85 -178.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -131.21 145.35 51.89 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.34 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.411 ' SG ' HD13 ' A' ' 1' ' ' LEU . 62.3 m -109.8 133.16 53.46 Favored 'General case' 0 C--N 1.272 -2.776 0 N-CA-C 104.871 -2.27 . . . . 0.0 104.871 171.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 51.4 p90 -116.06 146.36 42.26 Favored 'General case' 0 N--CA 1.42 -1.943 0 C-N-CA 118.702 -1.199 . . . . 0.0 112.551 -177.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 56' ' ' ASN . 21.9 t-160 -124.83 102.3 7.49 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.108 -1.405 . . . . 0.0 107.639 177.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.472 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 3.3 t-20 -88.5 118.54 28.22 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 174.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.7 p -82.6 -22.11 34.92 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 123.808 0.693 . . . . 0.0 110.655 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.47 -146.75 49.11 Favored Glycine 0 N--CA 1.429 -1.807 0 N-CA-C 109.099 -1.6 . . . . 0.0 109.099 -176.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 26.5 mmt -116.82 154.88 49.57 Favored Pre-proline 0 C--N 1.279 -2.461 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 174.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -63.08 112.03 1.57 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 121.524 1.483 . . . . 0.0 110.91 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 34.4 m-85 -116.13 140.24 49.5 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.407 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -62.51 107.49 0.95 Allowed 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.908 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 59.75 24.53 13.46 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.522 1.129 . . . . 0.0 111.167 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.77 113.02 14.19 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 121.328 0.585 . . . . 0.0 109.852 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -97.71 98.55 9.96 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -80.8 106.69 13.0 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 33' ' ' ILE . 17.0 mm -117.32 118.26 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.915 0 CA-C-O 121.956 0.884 . . . . 0.0 113.312 -175.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.472 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 6.2 mp -123.05 77.53 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.291 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.417 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 27.2 mt-30 -99.27 116.22 30.94 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.023 -0.989 . . . . 0.0 108.689 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.533 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -144.8 -173.37 16.04 Favored Glycine 0 CA--C 1.479 -2.162 0 C-N-CA 119.65 -1.262 . . . . 0.0 111.803 -179.191 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.3 m -113.5 138.13 50.56 Favored 'General case' 0 C--N 1.287 -2.144 0 N-CA-C 106.329 -1.73 . . . . 0.0 106.329 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -132.5 153.24 51.11 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 t -83.91 -46.05 12.54 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -113.87 -177.03 3.03 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.3 t -140.47 129.57 23.53 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.4 m -91.3 100.28 13.11 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 167.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.93 117.55 7.76 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.751 0.786 . . . . 0.0 112.799 -171.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.5 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 1.4 p -149.63 170.21 19.2 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.127 177.893 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -97.77 -18.49 18.76 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.465 0.65 . . . . 0.0 109.634 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -83.5 -27.69 29.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.108 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.5 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -118.17 95.41 4.88 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.566 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 79.7 tttt -79.0 108.25 12.34 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.481 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 28.5 p -100.12 119.85 38.96 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.5 p -130.68 155.96 45.72 Favored 'General case' 0 C--N 1.275 -2.661 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -115.11 21.61 14.07 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -112.77 151.54 30.2 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -65.16 134.89 54.7 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 110.538 -0.171 . . . . 0.0 110.538 -176.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 58.77 23.25 10.98 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.485 1.116 . . . . 0.0 113.029 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.7 p -71.09 -19.5 62.45 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 121.183 0.516 . . . . 0.0 111.472 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.513 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.5 p-10 -90.23 69.41 7.13 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 122.544 1.164 . . . . 0.0 110.998 -178.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttp . . . . . 0 N--CA 1.428 -1.535 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.691 -179.3 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.43 HD13 ' SG ' ' A' ' 19' ' ' CYS . 18.5 mt . . . . . 0 CA--C 1.487 -1.462 0 CA-C-O 121.037 0.446 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -110.38 113.67 26.51 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 5.5 m -123.87 164.18 19.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -172.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.412 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 81.6 m-85 -84.87 84.02 7.85 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -71.7 -42.42 67.4 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.19 -1.004 . . . . 0.0 110.584 178.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -106.02 7.12 31.77 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.56 0.695 . . . . 0.0 109.704 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.38 -14.58 63.3 Favored Glycine 0 C--N 1.31 -0.876 0 N-CA-C 107.926 -2.07 . . . . 0.0 107.926 -170.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.2 mttm -104.96 150.75 24.65 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.3 t -73.23 122.2 25.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 123.744 0.653 . . . . 0.0 110.384 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.8 m -121.57 151.07 24.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -84.01 113.34 20.93 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.5 m -83.77 143.5 29.93 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -65.95 169.5 6.65 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.225 0.466 . . . . 0.0 110.759 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -63.81 -9.78 16.62 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 124.295 1.038 . . . . 0.0 113.09 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -82.73 -29.0 30.07 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.439 ' HA ' ' HA ' ' A' ' 39' ' ' SER . 1.3 mpt? -81.98 101.65 10.44 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.529 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.09 -6.61 31.34 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.566 -177.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -134.8 148.61 50.23 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.267 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.43 ' SG ' HD13 ' A' ' 1' ' ' LEU . 25.3 m -99.77 137.18 38.6 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 171.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -112.35 147.29 36.68 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 118.173 -1.411 . . . . 0.0 111.313 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -126.7 101.57 6.68 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 114.515 -1.22 . . . . 0.0 107.823 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.554 HD22 ' HB2' ' A' ' 47' ' ' ASN . 25.2 t-20 -101.07 115.01 29.49 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 175.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.5 p -79.38 -27.86 41.9 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.094 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.38 -146.66 49.08 Favored Glycine 0 N--CA 1.427 -1.912 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.291 178.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 69.5 mtm -90.91 138.21 26.31 Favored Pre-proline 0 C--N 1.292 -1.892 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.9 123.96 9.31 Favored 'Trans proline' 0 C--O 1.252 1.185 0 C-N-CA 122.465 2.11 . . . . 0.0 110.851 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.457 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 61.1 m-85 -123.84 143.33 50.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.328 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -71.05 114.43 9.09 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.698 -176.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 67.1 t30 66.33 26.51 10.26 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.9 1.28 . . . . 0.0 110.07 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.457 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 3.1 tm? -130.87 129.08 41.84 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -102.29 94.89 5.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.493 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.7 tp -78.17 109.58 12.4 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.197 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.6 mm -113.55 101.65 12.77 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.646 0 CA-C-O 121.347 0.594 . . . . 0.0 111.671 -176.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.46 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 9.6 mp -109.64 61.48 0.6 Allowed 'General case' 0 C--N 1.306 -1.325 0 CA-C-O 122.269 1.033 . . . . 0.0 108.794 171.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -96.71 130.39 43.95 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.63 -160.41 8.76 Favored Glycine 0 C--N 1.278 -2.668 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.938 178.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 m -119.87 135.99 54.66 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.8 t -133.72 150.85 51.51 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.255 0.55 . . . . 0.0 110.82 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 16' ' ' MET . 13.1 t -77.17 -45.47 26.59 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.385 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.5 m -119.69 -175.79 3.03 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 43.2 t -125.46 138.69 54.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.003 0.43 . . . . 0.0 110.62 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.3 p -88.88 173.51 8.48 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 123.482 0.713 . . . . 0.0 110.652 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -91.92 17.73 8.83 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.112 0.482 . . . . 0.0 111.011 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.44 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 7.8 p -82.38 146.03 29.58 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.741 -175.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.08 -26.2 14.3 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -74.58 -27.16 60.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.554 ' HB2' HD22 ' A' ' 22' ' ' ASN . 8.9 t30 -115.81 96.75 5.75 Favored 'General case' 0 N--CA 1.416 -2.142 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 174.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -87.82 154.28 20.67 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.131 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 31.5 p -130.03 142.68 50.59 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 p -140.21 147.52 40.19 Favored 'General case' 0 C--N 1.278 -2.523 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 26.0 t -116.93 68.49 0.74 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.925 0.869 . . . . 0.0 110.968 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.0 m -148.78 144.99 27.37 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -69.54 130.59 42.87 Favored 'General case' 0 C--N 1.287 -2.129 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.499 -177.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.4 mtp-105 69.19 26.4 5.48 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.599 1.159 . . . . 0.0 111.524 -178.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 28.4 p -78.71 -26.37 44.83 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 178.425 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.431 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 32.3 p-10 -83.45 70.61 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.839 1.304 . . . . 0.0 110.044 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.428 -1.541 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.896 -172.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.428 HD13 ' SG ' ' A' ' 19' ' ' CYS . 19.5 mt . . . . . 0 CA--C 1.478 -1.807 0 CA-C-O 120.556 0.217 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 10.5 ptpp? -109.23 112.34 24.44 Favored 'General case' 0 N--CA 1.414 -2.238 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 174.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 74.0 m -136.26 165.06 26.64 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.197 -175.234 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.441 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 92.7 m-85 -82.02 63.0 6.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.415 0.626 . . . . 0.0 110.611 -176.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.515 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 52.8 tt0 -70.61 -31.99 69.17 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.927 -175.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -106.21 -7.36 17.9 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 122.155 0.979 . . . . 0.0 109.297 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.39 -18.07 30.61 Favored Glycine 0 C--N 1.305 -1.146 0 N-CA-C 108.099 -2.001 . . . . 0.0 108.099 -171.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 62.2 mttp -104.76 155.54 18.79 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.538 -1.331 . . . . 0.0 107.649 175.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.8 t -73.18 108.24 4.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.46 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 29.5 m -123.54 151.04 27.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 94.6 m -82.37 108.18 15.6 Favored 'General case' 0 N--CA 1.418 -2.073 0 CA-C-O 121.475 0.655 . . . . 0.0 109.524 176.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 58.3 m -76.7 136.94 39.11 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 176.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -57.21 162.35 2.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.568 0.747 . . . . 0.0 111.227 -172.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -62.33 -17.42 58.8 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -176.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 39' ' ' SER . 7.0 m-20 -71.01 -30.35 66.56 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.756 0.789 . . . . 0.0 109.117 176.231 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -79.03 101.41 7.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.451 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -91.92 -22.19 20.18 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.028 -178.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -127.42 137.31 52.69 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.479 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.428 ' SG ' HD13 ' A' ' 1' ' ' LEU . 60.2 m -103.49 127.82 50.81 Favored 'General case' 0 C--N 1.279 -2.468 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -109.57 159.73 16.84 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.767 -0.773 . . . . 0.0 111.948 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.417 ' NE2' ' HB ' ' A' ' 23' ' ' THR . 7.8 t-160 -129.99 101.46 5.85 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.859 177.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.558 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.0 t-20 -101.36 118.23 36.56 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.417 ' HB ' ' NE2' ' A' ' 21' ' ' HIS . 8.9 t -118.63 134.66 54.95 Favored 'General case' 0 C--N 1.287 -2.122 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.063 -177.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.37 171.88 48.33 Favored Glycine 0 N--CA 1.432 -1.578 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 176.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 64.4 mtt -75.9 147.04 80.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.83 106.08 0.6 Allowed 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 122.401 2.067 . . . . 0.0 112.892 -178.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.444 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 56.1 m-85 -121.97 144.34 48.94 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -58.18 121.64 11.21 Favored 'General case' 0 C--O 1.242 0.709 0 O-C-N 123.402 0.439 . . . . 0.0 110.578 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 69.05 7.68 6.38 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.682 1.193 . . . . 0.0 112.502 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 59.6 tp -126.95 102.88 7.19 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.103 0.477 . . . . 0.0 110.654 -178.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -110.64 98.98 8.02 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 tp -93.61 106.13 18.12 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.263 0.554 . . . . 0.0 109.58 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.431 HG23 ' HG3' ' A' ' 35' ' ' GLN . 15.4 mm -123.69 112.21 32.24 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.264 178.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.558 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.1 mt -119.83 70.55 0.86 Allowed 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 121.691 0.758 . . . . 0.0 109.203 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.431 ' HG3' HG23 ' A' ' 33' ' ' ILE . 26.2 mt-30 -86.06 118.73 25.71 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 173.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.515 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -139.53 -160.17 8.25 Favored Glycine 0 N--CA 1.425 -2.042 0 C-N-CA 120.002 -1.094 . . . . 0.0 112.506 -175.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 74.1 m -135.13 135.75 41.37 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 t -133.78 156.56 47.78 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 121.305 0.574 . . . . 0.0 110.836 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 18.2 m -76.59 -33.47 58.44 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.082 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.1 m -141.92 139.31 32.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.64 165.41 11.45 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.4 p -95.6 169.17 10.22 Favored 'General case' 0 N--CA 1.42 -1.94 0 C-N-CA 124.5 1.12 . . . . 0.0 110.566 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -93.34 27.93 2.4 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.612 0.72 . . . . 0.0 110.144 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.483 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.7 p -74.88 144.15 43.5 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.678 -178.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.39 -29.34 18.09 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -73.08 -44.34 60.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.102 176.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.483 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -93.15 99.17 11.8 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 176.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -89.29 151.61 22.01 Favored 'General case' 0 C--N 1.282 -2.327 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.5 -174.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.0 p -147.16 144.49 29.02 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.7 p -139.51 155.51 47.49 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 114.49 -1.232 . . . . 0.0 107.822 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -113.63 32.77 5.58 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.1 m -119.95 150.4 40.56 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -65.69 129.92 41.48 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.533 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 61.81 27.09 16.51 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.491 -1.232 . . . . 0.0 112.577 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 30.1 p -77.56 -25.14 49.8 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.446 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.538 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -83.59 73.8 10.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 122.947 1.356 . . . . 0.0 110.315 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.294 -1.832 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.271 -177.044 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.414 HD13 ' SG ' ' A' ' 19' ' ' CYS . 30.8 mt . . . . . 0 CA--C 1.488 -1.423 0 CA-C-O 121.203 0.525 . . . . 0.0 111.905 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HB2' ' CG1' ' A' ' 9' ' ' VAL . 20.3 pttp -110.77 113.95 26.93 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.203 172.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.49 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 85.0 m -135.82 164.02 28.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.274 0.559 . . . . 0.0 112.212 -174.301 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -81.39 85.02 6.51 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 122.129 -0.357 . . . . 0.0 111.324 -174.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 63.8 tt0 -81.4 -43.2 19.31 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.754 -1.178 . . . . 0.0 112.103 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -107.0 19.35 20.57 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.578 0.704 . . . . 0.0 111.259 -178.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.13 -38.05 3.46 Favored Glycine 0 CA--C 1.497 -1.049 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 -176.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -100.5 163.44 12.36 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.406 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 41.0 t -72.86 132.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 O-C-N 123.557 0.536 . . . . 0.0 111.244 -176.476 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -126.41 152.09 33.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 174.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.45 120.46 29.84 Favored 'General case' 0 C--N 1.283 -2.317 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.947 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.4 m -80.47 143.88 33.01 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -74.07 169.35 17.68 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.11 -7.59 42.73 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.8 -29.64 56.08 Favored 'General case' 0 CA--C 1.495 -1.141 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -77.91 126.52 30.97 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.326 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -108.18 -24.92 11.32 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.156 -175.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -133.73 143.63 48.6 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.204 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.414 ' SG ' HD13 ' A' ' 1' ' ' LEU . 61.6 m -102.56 119.9 39.62 Favored 'General case' 0 C--N 1.278 -2.51 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 170.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.9 p90 -99.59 149.53 23.17 Favored 'General case' 0 N--CA 1.42 -1.926 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.811 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.439 ' CE1' ' HB ' ' A' ' 23' ' ' THR . 6.0 t60 -125.73 101.82 7.04 Favored 'General case' 0 C--N 1.278 -2.523 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.855 178.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.452 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.3 t30 -110.3 106.91 16.47 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.439 ' HB ' ' CE1' ' A' ' 21' ' ' HIS . 10.2 t -100.37 170.89 8.11 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.69 -165.17 29.32 Favored Glycine 0 C--N 1.3 -1.446 0 C-N-CA 119.738 -1.22 . . . . 0.0 111.047 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 86.1 mtp -74.06 133.48 78.53 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.4 104.47 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.902 1.735 . . . . 0.0 112.975 -176.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -133.21 143.67 49.3 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 114.865 -1.062 . . . . 0.0 108.444 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.497 ' HA ' ' NE ' ' A' ' 28' ' ' ARG . 2.0 mmp_? -70.79 129.82 40.09 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 73.69 17.05 3.75 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.652 1.181 . . . . 0.0 111.201 -176.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.79 91.58 3.59 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -104.04 105.14 15.22 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 68.0 tp -104.54 106.69 17.28 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 mm -103.66 103.39 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.094 0 CA-C-O 121.809 0.814 . . . . 0.0 111.147 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 84.2 mt -123.58 63.53 1.03 Allowed 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 170.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.533 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 91.2 mt-30 -109.5 114.95 29.01 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.974 -1.467 . . . . 0.0 107.247 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.55 -170.72 13.97 Favored Glycine 0 C--N 1.286 -2.209 0 C-N-CA 119.314 -1.422 . . . . 0.0 112.174 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 20.8 m -111.44 132.14 54.69 Favored 'General case' 0 C--N 1.285 -2.219 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -133.85 154.32 51.11 Favored 'General case' 0 C--N 1.302 -1.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.755 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -86.69 -11.3 51.63 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.358 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.5 m -141.47 -169.05 2.79 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.7 t -148.7 151.55 35.11 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.7 t -114.03 110.48 20.11 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 170.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -70.81 97.33 1.37 Allowed 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 122.825 1.298 . . . . 0.0 111.273 -176.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.401 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 24.9 p -135.91 178.15 7.28 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.962 -176.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -94.95 -28.21 15.28 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.344 0.592 . . . . 0.0 109.752 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -88.3 -36.6 16.58 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.401 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.5 t30 -102.76 106.08 16.63 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -94.07 153.67 18.02 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.146 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.2 m -132.31 124.84 29.61 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.6 p -129.59 147.11 51.35 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -114.48 25.67 10.84 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.5 m -114.05 147.02 39.4 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -66.87 133.04 49.26 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.4 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 66.19 18.77 11.02 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 124.83 1.252 . . . . 0.0 112.693 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.5 p -65.35 -31.87 73.22 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.101 0.477 . . . . 0.0 111.685 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.522 HD22 ' HB3' ' A' ' 35' ' ' GLN . 36.9 p-10 -83.87 47.51 1.31 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.175 0.988 . . . . 0.0 111.107 -176.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt . . . . . 0 C--O 1.249 1.054 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.011 178.884 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.472 HD13 ' SG ' ' A' ' 19' ' ' CYS . 33.9 mt . . . . . 0 CA--C 1.472 -2.048 0 CA-C-O 120.712 0.291 . . . . 0.0 110.915 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.45 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 23.3 pttm -109.04 106.68 16.72 Favored 'General case' 0 N--CA 1.411 -2.409 0 CA-C-O 121.615 0.722 . . . . 0.0 109.121 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 85.3 m -131.07 166.14 21.71 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.83 -174.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -77.37 74.3 3.93 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.458 ' HA ' ' HA2' ' A' ' 36' ' ' GLY . 16.1 tm0? -85.85 -42.04 14.47 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.669 0.747 . . . . 0.0 109.337 178.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -100.42 20.46 14.83 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 122.329 1.061 . . . . 0.0 108.939 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.54 -35.66 3.79 Favored Glycine 0 CA--C 1.496 -1.141 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -176.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -104.46 163.13 12.67 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.9 t -68.09 114.37 4.87 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 123.893 0.746 . . . . 0.0 109.043 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 35.8 m -128.85 151.98 36.38 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.445 -177.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.7 m -76.3 106.27 7.82 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.0 m -79.49 144.62 33.82 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -63.68 167.77 5.51 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.331 0.652 . . . . 0.0 112.466 -170.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -55.53 -23.31 25.73 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 125.064 1.346 . . . . 0.0 112.595 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 39' ' ' SER . 15.7 m-20 -84.35 -26.62 28.31 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -175.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -74.32 101.67 4.12 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.25 -177.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.414 ' HG3' ' O ' ' A' ' 15' ' ' ASP . 47.1 mttp -94.42 -22.83 18.05 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.01 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -128.39 148.41 50.69 Favored 'General case' 0 N--CA 1.429 -1.525 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.369 -173.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.472 ' SG ' HD13 ' A' ' 1' ' ' LEU . 57.3 m -106.32 136.22 46.44 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 104.565 -2.383 . . . . 0.0 104.565 170.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 43.4 p90 -125.59 152.98 44.38 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.87 -174.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -130.4 102.61 6.25 Favored 'General case' 0 N--CA 1.421 -1.904 0 CA-C-N 113.886 -1.506 . . . . 0.0 107.007 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.601 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 5.0 t30 -90.27 102.29 15.02 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.0 p -67.85 -43.34 79.71 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.228 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.34 -152.52 41.66 Favored Glycine 0 N--CA 1.424 -2.121 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -176.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.471 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.2 mpp? -85.13 142.36 38.31 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.66 114.92 3.29 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.098 1.866 . . . . 0.0 109.947 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.471 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 52.3 m-85 -117.47 140.66 49.31 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 121.567 0.698 . . . . 0.0 110.614 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -91.87 127.88 37.5 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.726 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 65.9 t30 68.75 22.39 7.39 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.357 1.063 . . . . 0.0 110.064 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.1 tp -143.52 135.07 26.25 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.63 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -110.06 99.5 8.58 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.097 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -81.1 106.12 12.85 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 176.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.447 HD13 ' HA ' ' A' ' 33' ' ' ILE . 23.0 mm -112.15 115.01 48.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 CA-C-O 121.637 0.732 . . . . 0.0 112.74 -174.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.601 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 81.8 mt -133.94 72.84 1.48 Allowed 'General case' 0 N--CA 1.423 -1.808 0 CA-C-N 113.72 -1.582 . . . . 0.0 107.436 172.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -112.89 110.0 19.8 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.935 -177.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.458 ' HA2' ' HA ' ' A' ' 5' ' ' GLN . . . -145.19 -154.34 6.12 Favored Glycine 0 C--N 1.295 -1.75 0 C-N-CA 119.707 -1.235 . . . . 0.0 112.582 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.1 m -126.96 136.16 51.88 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 175.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.421 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 41.2 t -122.34 144.25 49.13 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.557 0.694 . . . . 0.0 111.663 -173.266 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 15.9 m -86.14 -30.2 22.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.724 178.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.2 m -142.19 104.27 4.42 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.0 t -116.52 136.85 52.64 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.634 -167.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.4 m -96.45 105.55 17.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.63 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.417 ' HG2' ' HB2' ' A' ' 49' ' ' CYS . 34.3 mt-10 -66.46 104.95 1.35 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.598 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -137.8 175.05 9.94 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.86 -36.52 64.87 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -63.76 -59.91 3.97 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.073 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.457 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 8.0 t30 -106.45 105.01 14.84 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.271 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 39.2 ttpt -86.22 116.71 24.57 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.17 -178.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.417 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 20.7 m -104.75 132.55 50.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.297 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.2 p -139.92 155.6 47.09 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.4 p -126.62 72.71 1.35 Allowed 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.819 0.819 . . . . 0.0 111.73 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.479 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 4.6 m -149.35 151.29 33.87 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 175.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.45 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 11.3 m-20 -66.86 126.08 27.93 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -177.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 69.93 18.88 7.16 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.499 1.52 . . . . 0.0 112.689 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.479 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.5 p -70.4 -20.35 62.94 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -176.08 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 28.9 p-10 -89.52 33.77 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.553 0.692 . . . . 0.0 110.786 -177.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 C--N 1.314 -0.935 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.574 -179.266 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 1' ' ' LEU . 21.5 mt . . . . . 0 CA--C 1.497 -1.09 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 11' ' ' THR . 21.8 pttp -110.91 116.18 30.79 Favored 'General case' 0 C--N 1.278 -2.518 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 169.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.5 m -133.78 165.22 25.48 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-O 121.125 0.488 . . . . 0.0 111.567 -172.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.569 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.6 m-85 -83.65 86.57 7.1 Favored 'General case' 0 C--O 1.189 -2.087 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 -174.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -76.88 -41.48 43.6 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.033 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -105.85 12.17 31.05 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.555 -177.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.77 -10.53 72.0 Favored Glycine 0 CA--C 1.517 0.217 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -171.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.535 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.3 mttt -105.51 153.29 21.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 28.0 t -76.93 108.89 10.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 O-C-N 123.316 0.385 . . . . 0.0 110.152 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.4 m -123.85 151.26 28.59 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 25.8 m -82.75 129.25 34.95 Favored 'General case' 0 C--N 1.285 -2.218 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -178.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 60.4 m -74.05 158.08 34.93 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.611 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 20.9 t-80 -70.71 165.53 22.79 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 -176.183 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -68.59 3.73 1.71 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -176.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.71 -12.75 15.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.552 0.692 . . . . 0.0 109.332 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.611 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -86.9 117.2 25.48 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.703 -172.033 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -104.57 -21.54 13.41 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.344 -1.298 . . . . 0.0 109.907 -177.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -128.86 150.0 50.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.84 -177.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 64.9 m -109.26 136.87 48.01 Favored 'General case' 0 C--N 1.276 -2.611 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -120.54 152.82 37.57 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.051 -176.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -134.68 101.87 5.09 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.547 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 5.2 t30 -97.74 104.7 16.75 Favored 'General case' 0 CA--C 1.485 -1.532 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.3 p -66.14 -36.47 83.22 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 123.797 0.686 . . . . 0.0 112.131 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.63 -132.09 29.36 Favored Glycine 0 N--CA 1.427 -1.945 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.39 124.28 36.22 Favored Pre-proline 0 C--N 1.282 -2.334 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -79.07 120.02 4.46 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.545 2.164 . . . . 0.0 111.37 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.459 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 96.9 m-85 -117.16 142.96 46.36 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -66.88 125.68 26.68 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.972 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 68.13 21.97 8.47 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.815 1.246 . . . . 0.0 111.586 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.459 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 54.7 tp -141.25 103.04 4.35 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.339 0.59 . . . . 0.0 111.092 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -83.75 98.25 9.58 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 tt -77.17 106.4 8.86 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 177.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.411 HG23 ' HG3' ' A' ' 35' ' ' GLN . 26.1 mm -104.57 111.26 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.743 -172.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.547 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 62.0 mt -126.28 59.33 1.34 Allowed 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.192 -1.367 . . . . 0.0 108.057 172.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.411 ' HG3' HG23 ' A' ' 33' ' ' ILE . 53.9 mt-30 -93.5 125.38 38.08 Favored 'General case' 0 N--CA 1.421 -1.898 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 176.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.4 -163.61 10.49 Favored Glycine 0 C--N 1.27 -3.124 0 C-N-CA 119.204 -1.475 . . . . 0.0 112.961 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 60.9 m -131.49 134.94 46.66 Favored 'General case' 0 C--N 1.286 -2.185 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 t -134.01 162.45 32.04 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.317 0.58 . . . . 0.0 110.217 -176.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -90.82 -15.73 29.53 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 177.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.4 m -132.7 -171.26 2.62 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.359 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.8 t -121.66 165.52 15.63 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.9 p -80.39 165.1 22.56 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 123.73 0.812 . . . . 0.0 112.007 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -85.83 -20.84 28.54 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.934 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 t -99.47 156.5 17.0 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.843 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -89.47 -15.61 32.69 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 123.972 0.795 . . . . 0.0 109.465 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -58.19 -32.12 67.95 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 122.618 1.199 . . . . 0.0 109.019 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 6.4 t30 -105.58 113.95 27.82 Favored 'General case' 0 N--CA 1.409 -2.502 0 CA-C-N 113.508 -1.678 . . . . 0.0 107.788 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -89.08 142.27 27.78 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.1 p -124.7 135.71 53.27 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.1 p -139.92 156.65 46.57 Favored 'General case' 0 C--N 1.269 -2.906 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 p -117.72 29.12 8.02 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -173.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.0 m -129.14 154.43 46.73 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.059 0.457 . . . . 0.0 110.985 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -50.98 124.51 11.48 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.06 0.944 . . . . 0.0 112.363 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 58.29 27.43 15.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.579 1.151 . . . . 0.0 113.68 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.2 p -76.59 -25.12 53.6 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -87.31 33.67 0.69 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -171.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.569 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 14.4 ptmm? . . . . . 0 C--N 1.302 -1.471 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.457 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.433 HD13 ' SG ' ' A' ' 19' ' ' CYS . 27.7 mt . . . . . 0 CA--C 1.479 -1.769 0 CA-C-O 121.574 0.702 . . . . 0.0 111.773 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 47.4 pttt -109.75 108.56 18.96 Favored 'General case' 0 C--N 1.28 -2.449 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.843 174.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.544 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 71.9 m -133.23 165.12 25.54 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.788 -173.059 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.46 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 91.8 m-85 -81.98 74.19 8.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.237 0.541 . . . . 0.0 110.623 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 43.6 tt0 -85.04 -35.83 21.63 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-O 121.444 0.64 . . . . 0.0 112.103 -177.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -105.81 9.44 32.91 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 122.26 1.029 . . . . 0.0 108.336 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 103.39 -38.33 3.28 Favored Glycine 0 CA--C 1.498 -1.009 0 N-CA-C 108.252 -1.939 . . . . 0.0 108.252 -174.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -93.05 162.81 13.89 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 113.925 -1.137 . . . . 0.0 108.217 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.406 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 57.6 t -71.77 123.2 25.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 16.5 m -120.48 152.12 23.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.67 103.02 15.54 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.7 m -82.43 142.06 32.25 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -69.66 170.88 9.95 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.4 mtm180 -76.32 -4.16 40.64 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -69.26 -31.62 70.27 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 171.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -82.14 101.32 10.35 Favored 'General case' 0 N--CA 1.422 -1.839 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.853 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -102.37 -8.27 21.32 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.278 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -134.71 136.11 42.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.257 -178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.433 ' SG ' HD13 ' A' ' 1' ' ' LEU . 82.9 m -101.69 136.41 41.57 Favored 'General case' 0 C--N 1.28 -2.447 0 N-CA-C 105.25 -2.129 . . . . 0.0 105.25 170.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.411 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 51.3 p90 -120.72 147.35 45.41 Favored 'General case' 0 C--N 1.293 -1.852 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.335 -176.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.659 ' CE1' ' HB ' ' A' ' 23' ' ' THR . 1.7 t60 -120.21 102.31 8.41 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.564 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 6.3 t30 -104.64 102.82 12.4 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.659 ' HB ' ' CE1' ' A' ' 21' ' ' HIS . 9.9 t -102.04 -162.96 0.97 Allowed 'General case' 0 C--N 1.273 -2.72 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.551 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.32 -102.68 0.27 Allowed Glycine 0 N--CA 1.416 -2.66 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.1 mtt -128.38 157.84 73.37 Favored Pre-proline 0 C--N 1.285 -2.228 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.65 105.46 1.1 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.4 1.4 . . . . 0.0 110.224 176.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -91.21 143.69 26.4 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.115 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.67 118.0 20.35 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.115 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 66.32 18.91 10.99 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.921 0.888 . . . . 0.0 111.735 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.0 tp -145.67 132.14 19.73 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -117.53 106.35 13.05 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 66.3 tp -80.96 106.22 12.79 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.467 HG23 ' HG3' ' A' ' 35' ' ' GLN . 25.1 mm -115.24 96.52 4.68 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.142 -177.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.564 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 84.2 mt -106.77 61.32 0.63 Allowed 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 173.666 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 88.5 mt-30 -97.93 120.13 37.77 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.533 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -145.84 -163.3 10.19 Favored Glycine 0 C--N 1.284 -2.325 0 C-N-CA 119.813 -1.184 . . . . 0.0 112.636 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.484 ' H ' ' NE2' ' A' ' 5' ' ' GLN . 74.0 m -122.17 137.68 54.74 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 173.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -133.68 157.43 45.83 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 t -81.37 -43.25 19.27 Favored 'General case' 0 N--CA 1.416 -2.127 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.0 p -105.58 178.85 4.44 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.9 t -120.52 126.65 50.89 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.491 0.186 . . . . 0.0 110.906 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.1 m -82.0 85.33 6.74 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.31 99.97 0.77 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.639 1.209 . . . . 0.0 113.023 -173.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.403 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 9.4 p -148.82 175.74 10.99 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-N 113.012 -1.904 . . . . 0.0 107.006 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -89.86 -32.55 16.84 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.052 0.454 . . . . 0.0 110.968 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -79.31 -36.91 38.86 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.807 0.337 . . . . 0.0 111.4 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.403 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 7.1 t30 -94.31 99.58 11.78 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 174.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -89.99 114.53 26.39 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.516 -174.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 32.0 p -104.2 136.02 44.59 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.38 176.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.7 p -139.54 155.6 47.41 Favored 'General case' 0 C--N 1.282 -2.361 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.997 -179.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -112.3 25.83 11.15 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.409 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 1.7 m -116.36 148.53 40.53 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -66.02 126.05 27.38 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 120.734 0.302 . . . . 0.0 111.175 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 65.7 24.75 11.53 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 124.843 1.257 . . . . 0.0 112.396 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.409 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 26.1 p -70.92 -19.56 62.57 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.177 0.513 . . . . 0.0 111.863 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.544 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 36.4 p-10 -89.43 70.54 8.06 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 122.469 1.128 . . . . 0.0 110.522 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.46 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 22.0 pttp . . . . . 0 C--N 1.306 -1.32 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.971 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 34.7 mt . . . . . 0 CA--C 1.484 -1.564 0 CA-C-O 120.858 0.361 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -110.92 113.58 26.26 Favored 'General case' 0 N--CA 1.415 -2.186 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.6 m -128.5 164.22 23.26 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.447 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 89.9 m-85 -82.78 76.94 9.6 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 122.37 -0.206 . . . . 0.0 111.371 -177.253 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.546 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 59.0 tt0 -77.92 -42.37 33.37 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.509 0.671 . . . . 0.0 111.187 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -90.91 -2.26 57.75 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.06 -14.96 62.17 Favored Glycine 0 C--N 1.307 -1.079 0 N-CA-C 107.242 -2.343 . . . . 0.0 107.242 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.4 mttt -105.03 155.82 18.62 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.3 t -70.87 113.13 6.52 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.1 m -125.88 152.22 32.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 16.1 m -82.37 126.62 32.39 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-O 121.185 0.517 . . . . 0.0 110.227 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.9 m -82.74 153.63 25.19 Favored 'General case' 0 C--N 1.297 -1.707 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.426 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.8 t-80 -67.62 160.88 26.97 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -62.88 -12.55 25.72 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -176.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -81.89 -24.34 35.75 Favored 'General case' 0 CA--C 1.504 -0.818 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.426 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.3 OUTLIER -73.51 126.0 29.23 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.699 -172.909 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -113.19 -24.25 9.52 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.13 -175.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -130.43 148.56 52.26 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.074 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.9 m -96.26 142.52 28.32 Favored 'General case' 0 C--N 1.286 -2.153 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 169.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.442 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 45.5 p90 -123.17 154.53 38.57 Favored 'General case' 0 C--N 1.294 -1.811 0 C-N-CA 118.466 -1.293 . . . . 0.0 111.429 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -131.97 106.05 7.8 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 174.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.436 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 27.0 t-20 -97.08 133.29 41.94 Favored 'General case' 0 C--N 1.289 -2.058 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 175.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.65 -164.35 1.8 Allowed 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -163.97 -75.65 0.03 OUTLIER Glycine 0 CA--C 1.476 -2.378 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 178.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 88.0 mtp -137.55 157.56 73.55 Favored Pre-proline 0 C--N 1.274 -2.71 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 175.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.62 143.64 24.33 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.946 1.764 . . . . 0.0 109.536 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.418 ' CB ' ' HB3' ' A' ' 30' ' ' LEU . 83.6 m-85 -116.18 142.9 46.21 Favored 'General case' 0 C--N 1.281 -2.4 0 CA-C-O 121.303 0.573 . . . . 0.0 112.221 -178.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -65.98 104.64 1.16 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.204 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 71.31 19.43 5.34 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 124.564 1.145 . . . . 0.0 111.301 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.418 ' HB3' ' CB ' ' A' ' 27' ' ' PHE . 66.0 tp -126.89 105.16 8.44 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -81.83 92.44 6.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 tt -82.9 106.26 14.58 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 20.9 mm -124.01 96.78 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.614 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.91 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.436 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 10.1 mp -104.98 60.91 0.69 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 170.153 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.563 ' HB3' HD22 ' A' ' 56' ' ' ASN . 25.8 mt-30 -103.45 126.52 50.65 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.583 -1.189 . . . . 0.0 108.262 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.04 -158.14 7.52 Favored Glycine 0 C--N 1.265 -3.39 0 C-N-CA 119.713 -1.232 . . . . 0.0 111.227 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 27.0 m -128.32 134.52 48.91 Favored 'General case' 0 C--N 1.281 -2.383 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.0 t -133.6 157.26 46.18 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.299 0.571 . . . . 0.0 110.245 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -87.8 -15.77 35.97 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.015 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.8 t -141.35 174.15 10.81 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.7 t -113.95 148.95 36.0 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 t -92.0 161.44 14.79 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -90.93 -12.45 36.01 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.985 0.421 . . . . 0.0 110.91 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -79.37 144.02 34.55 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-O 121.013 0.435 . . . . 0.0 110.478 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -2.88 53.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.991 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -76.89 -17.44 58.94 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.686 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -120.93 104.66 9.99 Favored 'General case' 0 N--CA 1.428 -1.572 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 53.4 mtpt -84.64 125.44 32.48 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.381 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.1 m -110.85 134.62 52.38 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.5 p -139.99 144.08 36.81 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -113.89 49.25 1.0 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -138.55 147.19 42.79 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 106.136 -1.801 . . . . 0.0 106.136 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -66.95 136.37 55.24 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.058 -177.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 63.72 19.77 11.89 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.438 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.0 p -68.12 -26.99 66.07 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.971 0.415 . . . . 0.0 110.841 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.563 HD22 ' HB3' ' A' ' 35' ' ' GLN . 36.2 p-10 -82.81 55.14 2.93 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 122.934 1.349 . . . . 0.0 111.09 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt . . . . . 0 N--CA 1.43 -1.474 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.196 -179.508 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.555 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 35.9 mt . . . . . 0 CA--C 1.482 -1.665 0 CA-C-O 121.095 0.474 . . . . 0.0 111.635 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 22.9 pttm -109.93 112.51 24.57 Favored 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 172.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.555 ' SG ' ' HB3' ' A' ' 1' ' ' LEU . 3.6 m -129.63 163.99 24.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.025 0.44 . . . . 0.0 110.622 -170.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.521 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 93.1 m-85 -81.36 90.48 6.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.057 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -83.95 -42.78 15.91 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.189 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -106.48 14.69 26.86 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.587 0.708 . . . . 0.0 109.181 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.2 -16.41 61.36 Favored Glycine 0 C--N 1.31 -0.91 0 N-CA-C 108.634 -1.786 . . . . 0.0 108.634 -172.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 92.1 mttt -105.09 159.01 16.17 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 56.3 t -81.4 119.05 30.24 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 123.612 0.57 . . . . 0.0 110.366 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 18.2 m -118.74 151.66 20.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.286 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.1 m -85.06 110.7 19.13 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.194 0.521 . . . . 0.0 109.752 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.4 m -85.77 140.76 30.2 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.986 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -71.42 172.35 9.62 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.769 -171.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -66.9 -10.55 49.82 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.506 1.122 . . . . 0.0 112.576 -177.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.407 ' HB2' ' SD ' ' A' ' 16' ' ' MET . 2.9 m-20 -73.94 -31.3 62.99 Favored 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 174.707 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.407 ' SD ' ' HB2' ' A' ' 15' ' ' ASP . 0.9 OUTLIER -86.8 114.13 23.21 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.814 -175.285 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -102.45 -16.28 16.23 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.964 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -134.25 145.27 48.98 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.091 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.524 ' SG ' HD13 ' A' ' 1' ' ' LEU . 33.7 m -92.74 140.81 29.14 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 168.466 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.54 ' CD2' ' HB2' ' A' ' 38' ' ' SER . 47.8 p90 -127.08 145.26 50.8 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.222 -1.391 . . . . 0.0 111.959 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -120.99 101.14 7.48 Favored 'General case' 0 C--N 1.274 -2.695 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 172.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.583 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.4 t-20 -104.48 138.05 41.44 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.4 t -162.4 -172.49 3.19 Favored 'General case' 0 N--CA 1.402 -2.869 0 N-CA-C 106.056 -1.831 . . . . 0.0 106.056 -177.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -139.08 -142.83 4.33 Favored Glycine 0 CA--C 1.481 -2.078 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -178.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.2 mtt -87.39 156.7 53.75 Favored Pre-proline 0 C--N 1.289 -2.047 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.09 106.39 1.71 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 121.709 1.606 . . . . 0.0 111.372 176.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.446 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 47.8 m-85 -107.43 138.24 43.99 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.3 mtp180 -60.04 123.81 18.27 Favored 'General case' 0 C--N 1.319 -0.731 0 O-C-N 123.124 0.265 . . . . 0.0 110.839 -177.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 69.75 4.99 4.99 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.757 1.223 . . . . 0.0 113.365 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 63.8 tp -120.2 88.82 3.01 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-O 121.575 0.702 . . . . 0.0 109.976 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -87.55 87.63 7.45 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.629 ' H ' HD23 ' A' ' 32' ' ' LEU . 2.2 pt? -82.17 113.1 19.77 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 121.658 0.742 . . . . 0.0 110.385 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.7 mm -123.51 111.86 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.604 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.583 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 91.0 mt -124.64 67.98 1.09 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.002 175.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -94.1 112.7 24.54 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.496 177.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.95 -158.15 7.52 Favored Glycine 0 C--N 1.283 -2.382 0 C-N-CA 120.104 -1.046 . . . . 0.0 110.927 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.7 m -123.87 134.34 53.59 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 175.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.54 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 45.7 t -112.37 144.59 41.56 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.263 0.554 . . . . 0.0 111.173 -173.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.8 m -86.46 -35.08 19.87 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 114.986 -1.007 . . . . 0.0 108.381 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.9 p -149.73 122.05 8.42 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.485 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.9 t -79.72 148.36 31.56 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.1 m -89.3 116.01 27.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 173.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -66.55 99.27 0.57 Allowed 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 122.241 1.019 . . . . 0.0 112.717 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.658 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.1 p -141.94 179.34 6.93 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.072 -179.297 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -94.95 -52.23 4.33 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.358 -178.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -76.76 -25.83 53.88 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.249 -173.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.658 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t30 -81.61 105.21 12.58 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 57.8 mtpt -88.3 120.32 29.55 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.736 -174.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.2 m -121.8 126.26 48.39 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -139.9 155.43 47.19 Favored 'General case' 0 C--N 1.284 -2.264 0 C-N-CA 121.28 -0.168 . . . . 0.0 110.71 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -104.75 32.91 3.84 Favored 'General case' 0 CA--C 1.558 1.254 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -173.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.2 p -130.47 147.26 52.14 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 121.733 -0.604 . . . . 0.0 111.421 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.437 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 75.2 m-20 -57.13 133.94 55.45 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.185 -177.098 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 78.6 mtm180 64.14 16.19 9.84 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 125.049 1.34 . . . . 0.0 114.031 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 25.6 p -75.96 -14.28 60.24 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.172 -0.611 . . . . 0.0 112.249 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -87.34 30.62 0.78 Allowed 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.641 -0.662 . . . . 0.0 111.454 -176.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.517 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 13.5 ptmm? . . . . . 0 C--O 1.254 1.319 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.521 HD13 ' SG ' ' A' ' 19' ' ' CYS . 19.1 mt . . . . . 0 CA--C 1.486 -1.484 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 36.2 pttt -109.93 110.43 21.38 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.183 172.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.511 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 72.9 m -136.9 164.34 28.56 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.984 -175.153 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.435 ' CE2' ' HB3' ' A' ' 54' ' ' ARG . 82.7 m-85 -84.4 81.58 8.77 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -176.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.502 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.1 tt0 -84.74 -42.94 14.75 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.223 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -106.17 19.07 21.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 -177.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.48 -38.59 3.15 Favored Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.45 153.8 24.28 Favored 'General case' 0 N--CA 1.426 -1.639 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.2 t -69.73 111.58 3.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 13.0 m -111.31 152.04 13.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.7 m -89.12 117.38 28.07 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.4 m -74.35 156.38 37.15 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.117 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.681 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.9 t-80 -64.29 160.57 18.47 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.87 0.868 . . . . 0.0 110.695 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.44 ' HE ' ' HB2' ' A' ' 14' ' ' ARG . 17.6 mtm180 -53.17 -40.47 64.38 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.451 1.1 . . . . 0.0 109.522 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -79.86 -8.52 59.34 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.571 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.681 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.4 OUTLIER -92.37 101.38 13.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 121.717 0.77 . . . . 0.0 109.598 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -88.46 -19.49 26.42 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.17 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -135.05 155.46 50.71 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.521 ' SG ' HD13 ' A' ' 1' ' ' LEU . 86.3 m -113.47 145.78 40.63 Favored 'General case' 0 C--N 1.279 -2.486 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 171.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.1 p90 -124.61 150.59 45.81 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.421 -178.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.458 ' CE1' HD11 ' A' ' 33' ' ' ILE . 78.3 t60 -127.24 111.94 14.53 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 177.561 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -102.27 105.85 16.56 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.515 ' O ' ' HA ' ' A' ' 46' ' ' ASN . 12.8 t -153.46 159.98 42.45 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.86 -51.73 0.7 Allowed Glycine 0 CA--C 1.467 -2.947 0 N-CA-C 108.099 -2.0 . . . . 0.0 108.099 -177.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 19.0 ptp -74.6 128.27 85.89 Favored Pre-proline 0 C--N 1.287 -2.149 0 CA-C-N 113.675 -1.262 . . . . 0.0 108.6 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -83.37 150.28 13.34 Favored 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 122.616 2.21 . . . . 0.0 111.783 -178.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -127.61 134.64 49.67 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.494 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -111.26 134.37 52.9 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.823 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.67 19.93 11.7 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.394 1.078 . . . . 0.0 111.562 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.7 tp -168.33 149.35 4.93 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 tptt -128.5 87.84 2.65 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 173.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -87.35 111.24 20.88 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.018 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.458 HD11 ' CE1' ' A' ' 21' ' ' HIS . 5.8 tp -122.67 99.29 6.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 CA-C-O 121.669 0.747 . . . . 0.0 109.625 179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.1 mt -85.0 85.34 7.49 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.994 0.902 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.502 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 3.4 pt20 -116.59 107.73 15.08 Favored 'General case' 0 C--N 1.276 -2.602 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.393 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.22 -150.85 5.33 Favored Glycine 0 C--N 1.295 -1.7 0 C-N-CA 119.907 -1.14 . . . . 0.0 112.596 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.5 m -120.39 136.81 54.6 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.2 t -133.99 154.6 51.01 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 121.572 0.701 . . . . 0.0 111.229 -177.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.3 t -80.85 -20.99 41.12 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.491 177.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.1 p -127.64 170.21 12.92 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 120.763 0.316 . . . . 0.0 111.672 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 45.3 t -127.03 104.01 7.77 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 m -97.2 96.47 8.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -78.89 103.98 9.21 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.051 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.1 p -134.93 176.76 8.36 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -81.91 -28.82 32.64 Favored 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.0 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' A' ' 23' ' ' THR . 7.8 t30 -81.95 -47.24 12.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -103.11 106.45 16.97 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 94.6 mttt -101.57 120.17 39.9 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.919 -177.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 p -110.24 130.49 55.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.268 0.556 . . . . 0.0 111.49 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.0 p -139.42 156.5 46.93 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.062 0.945 . . . . 0.0 110.566 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.7 m -118.41 28.77 8.14 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.401 ' OG1' ' HB3' ' A' ' 55' ' ' CYS . 1.6 p -111.77 153.28 26.75 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 121.542 -0.724 . . . . 0.0 112.041 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.66 115.36 1.22 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.968 0.907 . . . . 0.0 112.372 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.435 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 61.7 mtm180 57.17 33.82 23.89 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 124.283 1.033 . . . . 0.0 112.672 176.575 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.401 ' HB3' ' OG1' ' A' ' 52' ' ' THR . 27.7 p -69.15 -23.21 63.93 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.491 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.511 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.5 p-10 -84.38 70.64 10.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 123.394 1.568 . . . . 0.0 110.0 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 59.5 pttt . . . . . 0 N--CA 1.418 -2.059 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.966 -176.401 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 CA--C 1.486 -1.51 0 CA-C-O 121.269 0.557 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.633 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 18.6 pttm -109.66 118.26 36.09 Favored 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 172.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.581 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 92.1 m -132.6 164.57 26.38 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.645 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.431 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 77.4 m-85 -82.66 86.74 6.79 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.46 -174.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.626 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 63.1 tt0 -84.62 -42.09 15.73 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.062 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.421 ' C ' ' H ' ' A' ' 8' ' ' LYS . 30.2 m170 -106.6 20.18 19.39 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.544 -178.129 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.05 14.91 Favored Glycine 0 CA--C 1.502 -0.734 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 -173.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.421 ' H ' ' C ' ' A' ' 6' ' ' HIS . 35.4 mtmm -105.2 155.84 18.67 Favored 'General case' 0 N--CA 1.416 -2.153 0 C-N-CA 125.055 1.342 . . . . 0.0 108.331 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.2 t -73.16 118.38 18.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 123.75 0.656 . . . . 0.0 111.049 -176.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.7 m -114.22 151.14 16.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.268 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.1 m -90.91 101.97 14.73 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.055 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.4 m -74.09 141.45 45.66 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.94 163.68 19.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 -173.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -55.58 -20.64 14.14 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -178.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.491 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.4 m-20 -72.3 -25.16 61.47 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.653 0.74 . . . . 0.0 109.551 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.427 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -87.53 101.02 13.21 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.638 -175.241 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -98.39 -12.73 21.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.646 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.31 122.14 27.38 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -175.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 63.2 m -87.51 128.14 35.24 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 173.066 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.419 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 43.4 p90 -110.33 157.9 19.01 Favored 'General case' 0 C--N 1.296 -1.742 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.681 -172.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 19.4 t-160 -134.29 101.9 5.17 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.626 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 21.3 t-20 -93.97 96.31 9.61 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.352 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -85.05 -15.72 43.08 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.608 -173.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.428 ' HA2' HD21 ' A' ' 46' ' ' ASN . . . 68.22 -146.37 45.92 Favored Glycine 0 N--CA 1.43 -1.729 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.946 178.432 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 67.0 mtt -83.48 147.8 53.69 Favored Pre-proline 0 C--N 1.291 -1.937 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 175.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.93 113.01 3.09 Favored 'Trans proline' 0 C--O 1.247 0.975 0 C-N-CA 122.268 1.979 . . . . 0.0 111.723 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.437 ' HB3' ' HB3' ' A' ' 30' ' ' LEU . 55.6 m-85 -104.18 144.07 32.08 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.111 176.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -86.59 129.43 34.87 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 69.52 -4.14 1.45 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 124.466 1.106 . . . . 0.0 112.178 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 27' ' ' PHE . 6.9 tt -120.72 124.27 44.74 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -100.72 105.27 16.6 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tt -82.17 106.56 14.16 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 35.7 mm -115.24 98.8 7.35 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 CA-C-O 122.154 0.978 . . . . 0.0 112.478 -171.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.626 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 92.3 mt -111.79 66.85 0.64 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 170.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.626 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 27.9 mt-30 -99.94 115.0 28.65 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.135 178.267 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.17 -151.81 5.5 Favored Glycine 0 C--N 1.29 -1.977 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.225 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.435 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 74.3 m -131.3 135.01 46.93 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 178.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 t -130.48 149.27 52.23 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -177.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 17.7 m -66.53 -50.3 63.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -117.31 155.33 29.71 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 37.9 t -79.52 138.86 37.66 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.091 0.472 . . . . 0.0 111.675 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.8 t -87.54 115.4 24.94 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 172.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -91.58 95.46 9.94 Favored 'General case' 0 C--N 1.285 -2.225 0 CA-C-O 122.085 0.945 . . . . 0.0 112.341 -173.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.437 HG23 ' H ' ' A' ' 47' ' ' ASN . 5.1 t -159.6 155.56 26.45 Favored 'General case' 0 N--CA 1.414 -2.235 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.03 -30.8 70.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.428 HD21 ' HA2' ' A' ' 24' ' ' GLY . 38.9 t-20 -60.62 -36.15 77.91 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.107 178.202 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.437 ' H ' HG23 ' A' ' 44' ' ' THR . 7.4 t30 -113.31 115.03 27.51 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-O 121.489 0.662 . . . . 0.0 111.712 -174.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -87.31 153.05 21.77 Favored 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.5 m -133.71 136.07 44.42 Favored 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.1 p -139.77 155.84 47.08 Favored 'General case' 0 C--N 1.285 -2.233 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -121.27 27.64 8.24 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -174.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.0 m -122.08 153.16 39.02 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.782 -0.574 . . . . 0.0 109.527 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.633 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 4.9 m-20 -63.04 129.13 39.01 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 63.87 27.57 14.5 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.483 1.113 . . . . 0.0 112.22 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 27.1 p -75.26 -23.77 57.51 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.7 p-10 -88.26 72.38 9.04 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 123.151 1.453 . . . . 0.0 110.201 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 51.5 pttt . . . . . 0 C--N 1.284 -2.28 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.198 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.472 HD22 ' SG ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.628 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -109.28 116.99 32.93 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 120.835 0.35 . . . . 0.0 110.962 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.472 ' SG ' HD22 ' A' ' 1' ' ' LEU . 87.1 m -140.97 165.77 26.62 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.656 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.616 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 66.3 m-85 -82.93 82.91 7.99 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.306 -174.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.426 ' HB3' HG21 ' A' ' 10' ' ' VAL . 17.6 tm0? -84.68 -41.84 15.89 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.689 0.757 . . . . 0.0 110.075 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -103.35 19.46 19.64 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 122.394 1.092 . . . . 0.0 108.267 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.39 -27.4 11.99 Favored Glycine 0 C--O 1.219 -0.819 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 12.7 mptt -105.16 162.53 13.31 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.364 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.0 t -69.72 106.92 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 O-C-N 123.816 0.697 . . . . 0.0 110.703 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.426 HG21 ' HB3' ' A' ' 5' ' ' GLN . 30.8 m -117.53 152.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.4 m -87.9 112.64 22.75 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.331 0.586 . . . . 0.0 110.112 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.5 153.39 31.38 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -70.89 166.63 20.73 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.189 0.449 . . . . 0.0 110.954 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -65.88 -10.58 39.66 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.424 ' O ' ' HA ' ' A' ' 39' ' ' SER . 13.7 m-20 -77.05 -31.61 56.32 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 176.149 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.0 101.48 5.26 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.928 -174.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -94.11 -22.62 18.37 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.667 -178.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -126.2 147.02 49.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.346 -175.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -108.08 144.92 34.78 Favored 'General case' 0 C--N 1.272 -2.764 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 172.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 54.5 p90 -128.93 149.56 50.74 Favored 'General case' 0 N--CA 1.422 -1.848 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.807 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -126.72 102.36 7.03 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 174.52 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.557 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.3 t30 -104.38 112.25 25.22 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.358 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.4 p -69.19 -26.68 64.95 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 124.272 0.982 . . . . 0.0 113.004 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.37 -160.43 41.97 Favored Glycine 0 N--CA 1.428 -1.884 0 N-CA-C 109.921 -1.271 . . . . 0.0 109.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 99.1 mmm -98.79 138.36 20.68 Favored Pre-proline 0 C--N 1.288 -2.081 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.37 117.89 4.89 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.903 2.402 . . . . 0.0 113.28 -176.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -131.65 143.69 50.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -71.79 125.53 27.4 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 72.62 -3.29 2.39 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.22 1.408 . . . . 0.0 112.736 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.61 94.37 4.44 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-O 121.153 0.501 . . . . 0.0 110.672 -178.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -93.59 107.75 19.57 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 tp -77.03 105.52 8.16 Favored 'General case' 0 N--CA 1.424 -1.726 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 33' ' ' ILE . 30.6 mm -86.85 97.52 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 121.791 0.805 . . . . 0.0 110.938 -176.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.557 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 75.6 mt -111.53 63.99 0.62 Allowed 'General case' 0 N--CA 1.415 -2.181 0 CA-C-O 122.388 1.089 . . . . 0.0 108.872 172.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.1 112.64 25.38 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 113.884 -1.507 . . . . 0.0 107.505 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.8 -163.36 10.21 Favored Glycine 0 C--N 1.282 -2.425 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.983 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.6 m -125.83 142.44 51.51 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.0 t -133.93 154.31 51.17 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-O 121.191 0.519 . . . . 0.0 110.261 -177.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 5.5 m -71.02 -45.45 63.91 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.833 178.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.2 t -119.35 -171.36 2.1 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.3 t -128.52 134.87 48.78 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -90.27 101.08 13.8 Favored 'General case' 0 N--CA 1.426 -1.645 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 170.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.23 114.67 12.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.654 0.74 . . . . 0.0 112.949 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.595 HG23 ' H ' ' A' ' 47' ' ' ASN . 2.3 t -164.93 169.59 16.29 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 114.385 -1.28 . . . . 0.0 107.937 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -86.76 -24.85 24.95 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -75.35 -47.81 25.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.595 ' H ' HG23 ' A' ' 44' ' ' THR . 6.8 t30 -98.16 98.93 10.15 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.795 176.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.493 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 62.4 mttp -86.1 119.63 26.6 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.776 -177.245 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 56.8 m -102.84 131.74 49.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 21.3 p -139.46 156.07 47.18 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 3.3 p -126.89 33.44 4.94 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 13.4 m -119.5 157.78 27.61 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.1 124.58 22.0 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.682 0.277 . . . . 0.0 111.449 -176.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.7 mtm180 63.21 26.44 15.2 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 124.413 1.085 . . . . 0.0 111.756 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.7 p -72.76 -22.13 60.9 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -175.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -87.6 32.39 0.72 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.956 0.884 . . . . 0.0 111.716 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.616 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 N--CA 1.432 -1.338 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.352 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.47 HD13 ' SG ' ' A' ' 19' ' ' CYS . 25.1 mt . . . . . 0 CA--C 1.49 -1.34 0 CA-C-O 120.848 0.356 . . . . 0.0 111.668 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.441 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 23.5 pttm -109.16 107.57 17.9 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 173.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.608 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 76.5 m -135.25 165.94 24.27 Favored 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 -173.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 90.0 m-85 -79.66 74.01 6.35 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.491 0.662 . . . . 0.0 109.563 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.493 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 55.2 tt0 -84.59 -39.47 18.68 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.332 -177.232 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -106.08 19.67 20.16 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.755 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.86 -34.41 4.93 Favored Glycine 0 C--N 1.312 -0.777 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 38.2 mtmm -105.28 162.97 12.96 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.436 -0.882 . . . . 0.0 109.993 175.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.6 t -68.15 111.29 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 O-C-N 124.145 0.903 . . . . 0.0 108.791 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.493 ' CG2' ' HB3' ' A' ' 5' ' ' GLN . 34.1 m -130.85 152.27 37.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.8 m -76.9 112.63 13.71 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 121.383 0.611 . . . . 0.0 109.733 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.4 m -80.36 151.06 29.63 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.17 -0.923 . . . . 0.0 108.816 178.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.426 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 4.0 t-80 -61.95 162.43 9.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 122.924 0.49 . . . . 0.0 110.458 -174.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -69.27 -16.03 63.49 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -77.36 -23.67 50.8 Favored 'General case' 0 CA--C 1.496 -1.125 0 CA-C-O 121.531 0.681 . . . . 0.0 109.343 176.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.426 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.9 OUTLIER -78.45 101.37 7.27 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.513 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -90.11 -23.03 21.5 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.573 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -130.96 146.6 52.41 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.991 -172.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.47 ' SG ' HD13 ' A' ' 1' ' ' LEU . 32.0 m -110.67 130.63 55.52 Favored 'General case' 0 C--N 1.28 -2.427 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 172.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.4 p90 -119.45 162.08 19.45 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.767 -1.173 . . . . 0.0 113.587 -173.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 56.4 t60 -128.12 105.9 8.69 Favored 'General case' 0 N--CA 1.416 -2.17 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 169.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 34' ' ' LEU . 16.4 t-20 -97.75 123.18 41.58 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -178.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.8 p -91.35 120.83 32.55 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 120.989 0.424 . . . . 0.0 111.834 -175.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.96 -174.86 36.43 Favored Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 174.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 73.9 mtm -72.69 148.16 89.79 Favored Pre-proline 0 C--N 1.308 -1.197 0 CA-C-N 117.87 0.835 . . . . 0.0 109.609 177.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.24 110.31 1.97 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.183 1.922 . . . . 0.0 112.222 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.06 139.01 46.78 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -92.4 146.18 23.89 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.7 m120 66.85 7.42 5.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.154 0.982 . . . . 0.0 110.993 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.0 tp -147.9 88.47 1.68 Allowed 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -89.34 82.84 6.43 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.939 0.876 . . . . 0.0 109.968 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 pp -76.65 106.05 8.07 Favored 'General case' 0 N--CA 1.419 -2.005 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.3 tp -99.06 127.51 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.966 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.57 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 22' ' ' ASN . 80.3 mt -116.35 84.84 2.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -128.22 115.44 18.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.501 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.427 ' HA2' ' HA ' ' A' ' 5' ' ' GLN . . . -144.33 -177.97 19.64 Favored Glycine 0 N--CA 1.411 -2.978 0 N-CA-C 109.851 -1.299 . . . . 0.0 109.851 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.473 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 88.8 m -113.21 136.23 52.95 Favored 'General case' 0 C--N 1.275 -2.649 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.7 t -131.86 155.57 47.6 Favored 'General case' 0 C--N 1.293 -1.855 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.896 -174.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -84.16 -46.66 11.66 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 m -107.02 158.8 16.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 176.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 39.7 t -150.72 149.0 29.24 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 120.685 0.279 . . . . 0.0 110.887 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -119.8 92.46 3.79 Favored 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 170.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.07 110.07 1.7 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.04 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -139.19 -172.11 3.26 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-N 114.92 -1.037 . . . . 0.0 108.335 -177.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.16 -34.28 56.42 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 174.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -65.92 -57.91 6.78 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.129 -1.396 . . . . 0.0 109.995 178.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -110.56 109.79 20.25 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.179 0.514 . . . . 0.0 110.26 -177.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -101.88 121.96 43.1 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.613 -178.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 85.4 m -114.04 145.27 41.82 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-O 120.959 0.409 . . . . 0.0 111.493 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.9 p -139.67 154.81 47.6 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.6 m -128.47 70.31 1.37 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.699 0.761 . . . . 0.0 109.999 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.454 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 9.3 m -148.87 154.78 39.95 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.441 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 8.1 m-20 -63.91 126.08 26.49 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 -177.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 61.27 26.4 16.24 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.461 1.104 . . . . 0.0 112.595 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.454 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 30.1 p -71.64 -28.47 63.79 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.896 -0.721 . . . . 0.0 111.725 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.608 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.0 p-10 -90.85 69.44 6.45 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 122.704 1.24 . . . . 0.0 111.08 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.464 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.4 ptmt . . . . . 0 C--N 1.293 -1.884 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.095 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.41 ' HA ' ' OD1' ' A' ' 53' ' ' ASP . 28.9 mt . . . . . 0 CA--C 1.486 -1.507 0 CA-C-O 120.944 0.402 . . . . 0.0 111.514 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -110.63 113.3 25.8 Favored 'General case' 0 N--CA 1.414 -2.262 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.856 169.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 m -124.84 163.82 21.36 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -174.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.632 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 88.7 m-85 -80.12 94.0 5.91 Favored 'General case' 0 C--O 1.195 -1.791 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.492 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 61.8 tt0 -84.68 -38.86 19.27 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.901 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -106.59 7.8 30.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.871 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.95 -17.6 58.49 Favored Glycine 0 C--N 1.311 -0.839 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 -170.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -104.77 154.79 19.56 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 43.9 t -75.42 124.86 34.21 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 O-C-N 123.785 0.678 . . . . 0.0 110.04 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.9 m -130.37 152.37 37.36 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.9 m -79.31 119.27 22.12 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.6 m -76.97 163.38 26.77 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.342 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.57 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 7.4 t-80 -71.5 165.26 24.23 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.239 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.442 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 3.1 mmp_? -60.9 -21.53 63.44 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.385 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.85 -15.52 41.6 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 120.751 0.31 . . . . 0.0 111.042 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.57 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -76.79 103.5 6.78 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.664 0.745 . . . . 0.0 112.91 -173.198 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.15 -22.62 23.97 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.153 -178.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -134.77 151.88 51.31 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.937 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.8 m -96.99 129.46 44.45 Favored 'General case' 0 C--N 1.283 -2.317 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 169.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.427 ' CD2' ' HB2' ' A' ' 38' ' ' SER . 42.8 p90 -108.52 147.71 31.33 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 118.908 -1.117 . . . . 0.0 110.387 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -131.2 102.18 5.88 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 175.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.546 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.3 t-20 -97.93 103.55 15.5 Favored 'General case' 0 C--N 1.29 -1.98 0 N-CA-C 106.382 -1.711 . . . . 0.0 106.382 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.0 p -77.99 170.18 17.03 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 114.394 -1.275 . . . . 0.0 112.271 -173.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -153.99 171.68 32.64 Favored Glycine 0 N--CA 1.418 -2.518 0 N-CA-C 108.969 -1.652 . . . . 0.0 108.969 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 89.8 mtp -84.3 149.18 54.7 Favored Pre-proline 0 C--N 1.297 -1.68 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.17 112.45 3.43 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 121.951 1.767 . . . . 0.0 111.304 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -114.95 146.39 41.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -45.36 107.59 0.1 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.466 0.707 . . . . 0.0 111.659 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 68.3 17.9 9.22 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.768 1.227 . . . . 0.0 112.181 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.9 tp -141.08 93.33 2.58 Favored 'General case' 0 N--CA 1.428 -1.568 0 CA-C-O 121.806 0.812 . . . . 0.0 111.909 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -96.66 109.8 22.36 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 103.374 -2.825 . . . . 0.0 103.374 170.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.34 106.38 6.84 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 121.65 0.738 . . . . 0.0 109.737 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.42 ' HA ' HD13 ' A' ' 33' ' ' ILE . 18.4 mm -108.84 106.28 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.801 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.188 -176.005 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.5 mt -123.89 65.98 1.04 Allowed 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.891 174.322 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 52.2 mt-30 -102.61 116.99 33.71 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.56 -164.94 11.05 Favored Glycine 0 C--N 1.286 -2.204 0 C-N-CA 118.802 -1.666 . . . . 0.0 112.76 -178.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 24.5 m -117.73 135.39 54.06 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 177.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.427 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 47.4 t -133.98 152.73 51.96 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.336 -177.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 t -83.99 -34.13 24.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 43.6 p -115.35 -174.89 2.59 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.1 t -135.98 130.06 33.05 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.116 0.484 . . . . 0.0 111.885 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.2 m -91.87 104.43 16.86 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 172.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.16 102.33 5.72 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.462 -176.107 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.2 p -144.79 176.79 9.18 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -92.28 -17.53 24.63 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.873 0.844 . . . . 0.0 110.271 175.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -77.01 -37.85 54.21 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.192 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -113.2 108.28 17.06 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.379 0.609 . . . . 0.0 110.62 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -88.96 153.36 21.09 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.585 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.8 p -146.21 124.07 11.98 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.6 p -139.46 155.6 47.47 Favored 'General case' 0 C--N 1.278 -2.534 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 68.4 m -107.16 28.26 8.23 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -174.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.8 m -108.69 147.48 31.86 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.41 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 15.5 m-20 -65.9 124.4 22.4 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.434 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 66.16 28.34 10.17 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.479 1.112 . . . . 0.0 112.691 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.478 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.2 p -89.25 -9.07 52.04 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.624 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -85.21 37.63 0.68 Allowed 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.677 -0.639 . . . . 0.0 111.373 -176.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.632 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.5 pttm . . . . . 0 C--N 1.307 -1.257 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.758 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.646 HD13 ' SG ' ' A' ' 19' ' ' CYS . 17.0 mt . . . . . 0 CA--C 1.479 -1.775 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -109.3 101.83 10.8 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.481 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 70.9 m -133.39 164.52 26.94 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.054 0.454 . . . . 0.0 111.516 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.8 m-85 -82.31 83.43 7.44 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.0 -176.122 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -84.82 -41.84 15.69 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 119.508 -0.877 . . . . 0.0 110.403 177.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -106.38 19.3 20.72 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.532 0.682 . . . . 0.0 110.644 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.97 -35.46 4.54 Favored Glycine 0 C--N 1.305 -1.155 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -97.95 162.86 13.03 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 31.9 t -72.1 113.74 9.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 O-C-N 123.985 0.803 . . . . 0.0 109.473 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.12 151.88 34.49 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 34.4 m -79.86 121.62 25.64 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.17 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.3 m -86.33 136.95 32.95 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -62.13 165.02 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.921 0.763 . . . . 0.0 111.798 -170.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -64.44 -11.7 36.02 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.412 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.7 m-20 -78.92 -22.07 46.37 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -96.05 102.93 14.79 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.317 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -94.92 -16.62 22.7 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.248 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -130.61 130.81 44.47 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.607 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.646 ' SG ' HD13 ' A' ' 1' ' ' LEU . 45.2 m -95.84 143.89 26.66 Favored 'General case' 0 C--N 1.283 -2.298 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 174.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.528 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 48.4 p90 -126.77 153.1 46.01 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.986 -177.576 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.409 ' CE1' HD11 ' A' ' 33' ' ' ILE . 6.4 t60 -136.15 114.48 11.64 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.809 176.706 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.423 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 54.9 t-20 -76.45 112.84 13.4 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 175.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.7 t -151.75 -168.25 3.02 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 145.75 -94.96 0.17 Allowed Glycine 0 N--CA 1.427 -1.951 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.0 mtm -97.44 153.87 38.21 Favored Pre-proline 0 C--N 1.276 -2.6 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -60.53 126.96 21.26 Favored 'Trans proline' 0 C--O 1.254 1.298 0 C-N-CA 121.668 1.578 . . . . 0.0 110.672 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -73.88 130.09 39.2 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.651 -177.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -129.57 119.55 23.82 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.252 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m120 70.95 17.26 6.32 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.385 1.074 . . . . 0.0 110.371 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 tp -140.26 80.78 1.78 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -85.71 66.57 9.71 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 122.164 0.983 . . . . 0.0 111.044 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.75 122.77 39.52 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.361 -1.291 . . . . 0.0 108.851 174.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.409 HD11 ' CE1' ' A' ' 21' ' ' HIS . 5.6 tp -119.21 105.95 18.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.287 0 CA-C-O 121.792 0.806 . . . . 0.0 108.992 178.196 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB2' ' CB ' ' A' ' 22' ' ' ASN . 6.2 mp -94.97 91.91 6.61 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.962 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -119.26 112.01 18.93 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 176.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.42 -160.51 8.64 Favored Glycine 0 C--N 1.29 -2.021 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.92 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.481 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 76.4 m -138.26 137.25 37.31 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.9 t -133.96 155.37 50.06 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.097 0.475 . . . . 0.0 111.435 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 21.5 m -70.76 -39.03 73.47 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.426 -0.807 . . . . 0.0 110.085 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -131.9 132.65 43.8 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 20' ' ' TYR . 11.2 t -134.3 148.39 50.76 Favored 'General case' 0 C--N 1.294 -1.805 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.201 -173.225 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.9 m -98.68 100.17 11.36 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.12 110.84 1.97 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.062 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -148.21 176.65 10.06 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 -177.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -78.8 -29.27 44.8 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -71.32 -53.1 15.37 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.779 -1.1 . . . . 0.0 109.543 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -114.38 101.39 9.11 Favored 'General case' 0 N--CA 1.415 -2.182 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 60.3 tttm -82.86 108.02 15.9 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.673 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 34.0 m -100.13 128.12 46.26 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 p -140.19 156.15 46.63 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.637 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -115.96 34.99 4.67 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -174.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.1 m -136.59 156.3 48.75 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.055 -1.028 . . . . 0.0 111.237 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -48.31 122.62 5.5 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 124.904 1.282 . . . . 0.0 112.073 177.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 56.66 31.29 18.98 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.946 1.298 . . . . 0.0 113.409 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 31.9 p -77.25 -20.29 55.39 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.233 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.447 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 31.7 p-10 -89.91 67.06 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 122.925 1.345 . . . . 0.0 111.392 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.485 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.6 pttm . . . . . 0 N--CA 1.423 -1.8 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.57 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.404 HD13 ' SG ' ' A' ' 19' ' ' CYS . 31.0 mt . . . . . 0 CA--C 1.488 -1.43 0 CA-C-O 121.176 0.512 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 22.7 pttm -109.55 113.59 26.51 Favored 'General case' 0 N--CA 1.415 -2.18 0 CA-C-N 115.436 -0.802 . . . . 0.0 108.965 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.583 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 92.7 m -136.17 165.49 25.62 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.723 -174.699 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.551 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.6 m-85 -79.72 86.85 5.27 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.226 -174.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -85.09 -41.55 15.63 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.652 0.739 . . . . 0.0 111.389 177.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -106.49 -0.31 24.11 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.723 0.773 . . . . 0.0 111.052 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 121.68 -37.45 2.92 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 108.74 -1.744 . . . . 0.0 108.74 -175.438 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 19.1 ptpt -94.96 161.97 13.93 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.433 HG12 ' HB2' ' A' ' 2' ' ' LYS . 16.5 t -75.85 122.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.202 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.6 m -130.41 151.57 36.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 98.0 m -72.11 118.86 15.51 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.75 158.61 22.78 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.694 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 12.5 t-80 -61.07 159.63 11.41 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.55 0.74 . . . . 0.0 111.977 -173.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -51.77 -32.37 30.74 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.282 1.433 . . . . 0.0 111.984 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 39' ' ' SER . 10.1 m-20 -86.34 -14.17 44.34 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.163 0.506 . . . . 0.0 110.815 -174.298 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.694 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.5 OUTLIER -83.1 100.41 10.5 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.093 -176.31 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -97.55 -14.85 20.8 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.029 -177.043 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -131.36 147.85 52.61 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.485 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 57.4 m -107.38 145.97 32.23 Favored 'General case' 0 C--N 1.267 -2.981 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 174.054 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.446 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 47.7 p90 -130.83 147.48 52.49 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.715 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -119.5 101.71 8.13 Favored 'General case' 0 C--N 1.273 -2.737 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 172.047 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.616 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 23.7 t-20 -105.67 135.03 47.83 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.0 t -141.53 175.78 9.41 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -176.446 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.48 -157.96 20.5 Favored Glycine 0 CA--C 1.498 -1.007 0 C-N-CA 120.121 -1.038 . . . . 0.0 111.996 -176.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.9 mtm -75.55 128.81 83.26 Favored Pre-proline 0 C--N 1.313 -1.021 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -67.31 104.89 0.95 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 121.926 1.751 . . . . 0.0 113.46 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -132.52 145.62 51.3 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 125.728 1.611 . . . . 0.0 106.993 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -55.2 116.9 3.06 Favored 'General case' 0 C--O 1.245 0.857 0 O-C-N 123.41 0.444 . . . . 0.0 110.826 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 81.33 -3.38 1.68 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.233 1.413 . . . . 0.0 113.592 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -87.93 84.72 6.96 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.8 pttt -106.38 87.61 2.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.476 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.7 tp -83.98 106.06 15.35 Favored 'General case' 0 N--CA 1.417 -2.11 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.8 mm -104.28 100.7 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.947 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.688 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 90.1 mt -120.7 63.8 0.85 Allowed 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.37 -1.287 . . . . 0.0 107.537 174.061 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -91.6 114.84 27.48 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.94 -160.96 8.94 Favored Glycine 0 C--N 1.291 -1.956 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.686 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.583 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 78.2 m -128.4 145.34 51.12 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 173.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -133.89 162.13 32.87 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 16.2 t -82.0 -22.67 36.41 Favored 'General case' 0 N--CA 1.417 -2.108 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.164 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.8 p -133.01 176.41 8.52 Favored 'General case' 0 N--CA 1.424 -1.739 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 10.8 t -112.53 115.54 28.8 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.466 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.5 m -77.89 97.08 5.16 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 172.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.65 86.92 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 124.555 1.142 . . . . 0.0 114.067 -172.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.471 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 30.5 p -147.99 163.59 36.4 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 176.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -90.44 -17.18 27.62 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.284 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -72.52 -44.23 62.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.815 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.488 ' HB2' HD22 ' A' ' 22' ' ' ASN . 7.8 t30 -98.97 95.55 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 174.334 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 66.7 mttm -80.87 110.61 16.57 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.3 -175.255 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.7 p -99.79 133.6 43.91 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 22.2 p -140.27 156.36 46.5 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.6 p -132.21 68.03 1.51 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 121.346 0.594 . . . . 0.0 111.583 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -149.02 156.71 42.65 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.437 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 12.2 m-20 -61.99 127.86 33.38 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.6 mtt180 61.71 26.12 15.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.885 0.874 . . . . 0.0 113.064 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 28.2 p -72.02 -28.79 63.6 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.528 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.2 p-10 -86.82 66.28 9.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.537 1.16 . . . . 0.0 111.403 -176.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.551 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 23.5 pttm . . . . . 0 C--N 1.296 -1.721 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.313 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 C--O 1.207 -1.147 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.4 ' HE3' ' OD1' ' A' ' 53' ' ' ASP . 48.9 pttt -109.27 119.64 40.11 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.547 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 93.2 m -140.93 164.59 29.86 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.53 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.604 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 86.6 m-85 -80.64 89.2 5.7 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.62 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.532 ' HG2' ' HA2' ' A' ' 36' ' ' GLY . 25.6 mt-30 -80.31 -43.1 21.81 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.021 -1.072 . . . . 0.0 112.164 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -106.95 14.47 26.46 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.756 0.789 . . . . 0.0 109.371 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.73 -9.67 70.89 Favored Glycine 0 N--CA 1.44 -1.066 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -173.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.604 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.1 mttm -105.84 152.4 23.29 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 176.69 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.5 t -76.65 106.45 6.58 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -119.19 152.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 120.654 0.264 . . . . 0.0 111.022 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.9 m -79.43 106.03 11.17 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-O 121.274 0.559 . . . . 0.0 110.773 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 m -86.34 133.96 33.76 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 173.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -70.26 174.56 5.45 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.129 0.268 . . . . 0.0 110.652 -173.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 57.9 mtm180 -75.75 -3.87 37.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.234 0.54 . . . . 0.0 111.719 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -76.03 -29.8 58.22 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -86.04 101.02 12.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.27 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -91.41 -17.31 25.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.723 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -135.14 130.37 35.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.151 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 60.0 m -94.32 145.18 24.93 Favored 'General case' 0 C--N 1.277 -2.574 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 172.541 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -127.86 155.98 43.29 Favored 'General case' 0 C--N 1.282 -2.34 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.999 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -138.44 102.32 4.59 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 177.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.497 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.0 t30 -107.72 95.83 5.97 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 177.478 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 t -88.5 136.6 32.91 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.372 -171.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.76 135.96 23.85 Favored Glycine 0 N--CA 1.428 -1.867 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.774 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -62.65 155.7 68.09 Favored Pre-proline 0 C--N 1.315 -0.922 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.01 107.65 0.33 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 122.942 2.428 . . . . 0.0 113.322 179.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -132.33 143.69 50.04 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 174.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -71.24 115.65 10.64 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.406 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 71.98 -3.61 2.18 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.17 1.388 . . . . 0.0 113.499 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 36.1 tp -118.26 120.58 38.1 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.224 -0.591 . . . . 0.0 110.359 -177.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.34 89.19 2.48 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.022 0.915 . . . . 0.0 109.202 174.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.523 ' H ' HD23 ' A' ' 32' ' ' LEU . 2.0 pt? -76.35 106.11 7.79 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.426 HD12 ' O ' ' A' ' 22' ' ' ASN . 6.4 tp -121.05 118.89 57.7 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.114 -171.067 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.497 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 83.0 mt -115.42 98.43 6.73 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 177.255 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 3.8 pt20 -130.91 104.36 7.09 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-O 121.26 0.553 . . . . 0.0 110.223 -179.473 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.532 ' HA2' ' HG2' ' A' ' 5' ' ' GLN . . . -145.17 -144.46 4.14 Favored Glycine 0 N--CA 1.419 -2.48 0 C-N-CA 119.932 -1.127 . . . . 0.0 112.253 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 83.0 m -132.01 133.39 44.39 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.1 t -131.0 163.74 26.91 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-O 121.337 0.589 . . . . 0.0 109.643 -178.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.0 t -82.29 -15.16 53.93 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.366 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.2 m -141.16 164.53 30.0 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.0 t -97.43 129.29 44.66 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -78.45 105.67 9.87 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -78.53 114.23 17.25 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.717 -177.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.444 HG23 ' H ' ' A' ' 47' ' ' ASN . 11.3 t -173.22 -174.61 1.06 Allowed 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.71 -42.55 13.28 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 118.46 0.573 . . . . 0.0 111.96 -175.14 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -79.5 -27.07 41.45 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -173.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.444 ' H ' HG23 ' A' ' 44' ' ' THR . 7.7 t30 -90.63 107.35 19.11 Favored 'General case' 0 CA--C 1.491 -1.314 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.361 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -91.43 145.04 24.96 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.3 p -132.39 136.2 46.64 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.47 0.653 . . . . 0.0 111.115 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.2 p -140.09 157.35 45.77 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.92 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 m -124.88 45.14 2.61 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.8 t -148.03 165.42 30.82 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.868 179.319 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.4 ' OD1' ' HE3' ' A' ' 2' ' ' LYS . 1.0 OUTLIER -52.4 121.25 6.64 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 114.705 -1.134 . . . . 0.0 113.149 -176.804 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 45.9 mtm180 60.58 22.24 12.02 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 124.902 1.281 . . . . 0.0 113.579 175.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.9 p -71.21 -25.71 62.63 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -175.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -87.97 29.17 0.95 Allowed 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.113 0.482 . . . . 0.0 111.609 -174.175 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.565 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 C--O 1.254 1.331 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.238 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 24.6 mt . . . . . 0 CA--C 1.486 -1.516 0 CA-C-O 120.861 0.362 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -109.66 115.27 29.56 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.199 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.513 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 94.2 m -139.78 165.17 28.0 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.948 0.404 . . . . 0.0 111.887 -174.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.527 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 88.9 m-85 -75.33 87.11 2.53 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.347 -176.294 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -84.97 -41.73 15.59 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.825 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -102.41 -4.48 25.42 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.232 1.015 . . . . 0.0 109.215 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.2 -23.86 7.14 Favored Glycine 0 N--CA 1.429 -1.8 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -175.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 65.3 pttt -102.05 161.2 13.86 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.32 117.34 23.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.7 m -123.48 152.43 28.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 178.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.8 m -77.89 111.8 14.1 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.59 152.61 28.48 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -74.96 166.66 23.31 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 110.659 -0.126 . . . . 0.0 110.659 -173.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -53.02 -27.71 20.79 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.965 1.306 . . . . 0.0 112.623 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.552 ' O ' ' HA ' ' A' ' 39' ' ' SER . 6.6 m-20 -69.4 -31.14 69.32 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.473 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.1 OUTLIER -86.93 101.01 13.0 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.364 -175.209 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -110.94 -3.61 15.53 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.488 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.89 124.41 24.95 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 67.1 m -93.6 140.68 29.34 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.055 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.5 p90 -121.57 147.94 45.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 121.412 0.625 . . . . 0.0 111.71 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.419 ' HB2' ' HB2' ' A' ' 56' ' ' ASN . 1.9 t60 -135.66 101.44 4.78 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.576 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 19.5 t-20 -83.54 125.91 32.26 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 175.077 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 53.3 p -71.69 -13.8 61.84 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 123.744 0.652 . . . . 0.0 111.803 -174.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.4 -173.36 54.14 Favored Glycine 0 N--CA 1.423 -2.214 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.754 179.131 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 92.4 mtp -133.87 108.03 11.71 Favored Pre-proline 0 C--N 1.292 -1.909 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.89 108.48 1.92 Allowed 'Trans proline' 0 C--O 1.249 1.06 0 C-N-CA 122.577 2.185 . . . . 0.0 114.679 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -131.82 143.93 50.55 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 174.237 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -52.46 120.81 6.01 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.413 0.446 . . . . 0.0 112.133 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.0 m120 70.32 10.08 7.17 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.268 1.427 . . . . 0.0 112.931 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -113.75 88.31 2.82 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 175.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -85.82 83.48 7.82 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.9 tp -83.35 105.36 14.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.414 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.459 HD13 ' HA ' ' A' ' 33' ' ' ILE . 5.1 mm -125.23 121.13 59.95 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.014 178.322 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.576 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 48.6 mt -127.51 78.0 1.79 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -102.17 109.11 20.72 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.83 -158.76 7.85 Favored Glycine 0 C--N 1.292 -1.91 0 C-N-CA 119.895 -1.145 . . . . 0.0 112.539 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.3 m -132.07 139.64 48.59 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 176.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 t -132.25 161.02 34.49 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 120.874 0.369 . . . . 0.0 110.09 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.552 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 23.0 t -76.2 -33.81 59.27 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.217 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 t -137.29 151.12 48.33 Favored 'General case' 0 N--CA 1.417 -2.096 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 9.6 t -70.45 119.86 15.24 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 177.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.9 m -80.88 87.87 5.9 Favored 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.87 100.67 0.06 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.02 -172.188 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.508 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 3.7 p -142.53 159.48 42.16 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.693 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -84.23 -27.5 27.92 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -88.18 -0.49 57.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.552 0.691 . . . . 0.0 110.613 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.508 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.1 t30 -125.0 130.26 51.99 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.272 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -96.14 126.86 41.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.8 p -120.44 129.21 53.79 Favored 'General case' 0 C--N 1.283 -2.321 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -140.23 156.13 46.62 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.638 -177.513 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.3 p -110.09 27.31 9.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.6 m -119.98 150.54 40.36 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.56 136.25 55.36 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.501 -0.479 . . . . 0.0 109.986 -175.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 63.88 15.86 9.43 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.494 1.117 . . . . 0.0 113.007 177.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.401 ' C ' ' H ' ' A' ' 57' ' ' LYS . 30.1 p -73.28 -12.57 60.89 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.961 0.41 . . . . 0.0 111.749 -177.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.419 ' HB2' ' HB2' ' A' ' 21' ' ' HIS . 28.9 p-10 -92.48 29.78 1.64 Allowed 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.819 1.295 . . . . 0.0 109.023 -174.415 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.439 ' HG2' ' CE2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.415 -2.204 0 C-N-CA 127.924 2.489 . . . . 0.0 109.332 -177.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.559 HD13 ' SG ' ' A' ' 19' ' ' CYS . 25.2 mt . . . . . 0 CA--C 1.489 -1.396 0 CA-C-O 121.454 0.645 . . . . 0.0 112.248 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -110.15 117.81 34.69 Favored 'General case' 0 N--CA 1.414 -2.263 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 171.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.545 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 95.5 m -138.51 164.51 29.23 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 120.777 0.322 . . . . 0.0 111.104 -176.016 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -80.88 75.0 7.84 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.388 0.613 . . . . 0.0 110.742 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -80.27 -40.67 26.46 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.256 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -106.28 20.03 19.6 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-O 121.476 0.655 . . . . 0.0 109.875 -177.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.6 -39.16 3.03 Favored Glycine 0 CA--C 1.498 -1.013 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -91.3 150.33 21.35 Favored 'General case' 0 C--O 1.258 1.514 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 173.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.0 p -75.22 112.59 12.94 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.211 0 CA-C-O 121.611 0.72 . . . . 0.0 111.108 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -119.29 153.0 21.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.114 -175.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.4 m -78.75 116.17 18.92 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.427 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.4 m -80.09 158.26 26.47 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t-80 -65.76 162.87 17.8 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.249 0.477 . . . . 0.0 110.802 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -63.77 -12.25 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -79.54 -21.39 45.23 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.627 0.727 . . . . 0.0 109.365 177.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.2 mtt -86.28 101.43 13.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.85 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -93.67 -18.5 22.08 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.84 -177.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -131.85 150.84 52.03 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.693 -176.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.559 ' SG ' HD13 ' A' ' 1' ' ' LEU . 58.2 m -112.75 138.13 50.03 Favored 'General case' 0 C--N 1.276 -2.626 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 172.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -116.34 148.0 41.02 Favored 'General case' 0 C--N 1.297 -1.689 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.446 -175.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 37.9 t60 -124.57 101.93 7.37 Favored 'General case' 0 N--CA 1.413 -2.275 0 CA-C-N 113.904 -1.498 . . . . 0.0 106.977 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 47' ' ' ASN . 47.3 t-20 -102.62 130.04 49.39 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 38.4 p -83.21 -11.37 57.91 Favored 'General case' 0 C--N 1.289 -2.041 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.45 -134.02 12.42 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.5 mmm -118.04 148.23 43.08 Favored Pre-proline 0 C--N 1.281 -2.396 0 N-CA-C 105.301 -2.111 . . . . 0.0 105.301 173.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -64.98 104.25 0.56 Allowed 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 120.94 1.093 . . . . 0.0 111.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -133.34 143.72 49.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.858 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 -99.29 149.8 22.76 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 66.1 t30 70.87 13.05 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.435 1.094 . . . . 0.0 110.451 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.5 tp -119.96 106.94 12.52 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.775 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -105.62 89.17 3.02 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.4 mt -122.04 130.02 52.92 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.431 HD13 ' HA ' ' A' ' 33' ' ' ILE . 7.7 mm -95.53 129.3 45.83 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 CA-C-O 121.455 0.645 . . . . 0.0 111.77 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.465 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 5.6 mp -120.17 68.91 0.85 Allowed 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.812 175.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.46 ' HB3' HD22 ' A' ' 56' ' ' ASN . 93.5 mt-30 -122.6 113.5 19.35 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.27 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.01 -159.28 8.01 Favored Glycine 0 C--N 1.285 -2.259 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 19' ' ' CYS . 85.8 m -125.92 148.88 49.1 Favored 'General case' 0 C--N 1.285 -2.201 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.3 t -133.6 148.59 51.59 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.199 0.523 . . . . 0.0 110.564 -174.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.0 t -81.43 -40.33 23.53 Favored 'General case' 0 N--CA 1.425 -1.705 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.148 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.1 p -139.98 96.78 3.12 Favored 'General case' 0 N--CA 1.426 -1.651 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 15.3 t -92.14 153.94 19.01 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.761 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.1 t -110.27 109.39 19.83 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.46 ' HG3' ' HB2' ' A' ' 49' ' ' CYS . 2.5 mp0 -70.38 108.95 4.48 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.782 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.2 p -127.12 -169.58 2.06 Favored 'General case' 0 C--N 1.288 -2.1 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -97.78 -15.6 20.23 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 174.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.91 -42.96 23.05 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.666 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 5.5 t30 -125.41 118.5 25.99 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.505 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -95.96 145.01 25.77 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.46 ' HB2' ' HG3' ' A' ' 43' ' ' GLU . 34.0 m -123.33 116.29 23.07 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.85 148.98 40.79 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.0 p -118.62 22.21 12.15 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.559 0.695 . . . . 0.0 111.279 -175.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.8 m -116.31 147.8 41.2 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -65.05 138.87 58.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.448 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 62.87 19.7 11.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.365 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.3 p -67.0 -35.59 80.28 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.545 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -87.22 56.05 3.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.803 1.287 . . . . 0.0 111.529 -176.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? . . . . . 0 C--N 1.301 -1.504 0 CA-C-N 114.232 -1.349 . . . . 0.0 110.417 -179.845 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 1' ' ' LEU . 19.4 mt . . . . . 0 CA--C 1.487 -1.457 0 CA-C-O 121.286 0.565 . . . . 0.0 112.134 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -110.8 123.26 49.74 Favored 'General case' 0 N--CA 1.416 -2.129 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 170.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 m -133.33 162.0 32.99 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -176.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.486 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.3 m-85 -81.36 85.34 6.45 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.406 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 57.7 tt0 -77.45 -43.16 33.34 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 120.952 0.406 . . . . 0.0 111.867 -177.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -107.76 18.39 21.41 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.318 1.056 . . . . 0.0 109.203 174.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.79 -16.85 59.08 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -105.17 140.74 37.88 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.423 HG21 ' HG2' ' A' ' 54' ' ' ARG . 5.6 p -74.96 115.02 15.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 CA-C-O 122.007 0.908 . . . . 0.0 111.744 -178.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.5 m -120.35 152.29 23.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.976 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.9 m -71.84 118.04 14.18 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.373 0.606 . . . . 0.0 109.564 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.3 m -79.31 157.13 27.77 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -68.17 161.41 27.1 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -64.55 -6.45 7.54 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -81.37 -31.39 33.36 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -72.02 101.96 2.85 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.806 -174.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -95.42 -17.08 21.82 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.904 -1.498 . . . . 0.0 109.88 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -135.02 148.0 49.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.4 m -98.06 137.99 36.04 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 170.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.522 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 52.5 p90 -116.34 142.84 46.32 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 118.474 -1.291 . . . . 0.0 111.767 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -115.34 122.57 46.28 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -112.81 126.21 55.19 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 29.6 p -92.88 79.99 4.66 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.696 0.76 . . . . 0.0 110.765 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 32' ' ' LEU . . . -71.74 131.67 19.0 Favored Glycine 0 N--CA 1.432 -1.603 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.734 -177.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -55.68 151.47 22.16 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 124.642 1.177 . . . . 0.0 111.66 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.2 110.67 3.05 Favored 'Trans proline' 0 C--O 1.253 1.265 0 C-N-CA 122.383 2.055 . . . . 0.0 112.209 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -114.67 144.01 44.11 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 175.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -62.19 110.31 1.58 Allowed 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.489 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.4 m120 72.73 19.28 4.01 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 125.019 1.328 . . . . 0.0 111.861 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.2 tt -144.6 93.56 2.43 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-O 121.939 0.876 . . . . 0.0 109.088 176.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -93.43 107.19 19.07 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.526 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 66.0 tp -76.84 106.12 8.31 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-O 121.938 0.875 . . . . 0.0 110.555 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' A' ' 33' ' ' ILE . 10.3 mm -124.36 112.99 34.56 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.929 173.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -86.65 -66.37 0.91 Allowed 'General case' 0 N--CA 1.425 -1.713 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.086 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.522 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 28.7 mt-30 40.84 90.39 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 O-C-N 124.684 1.24 . . . . 0.0 113.436 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.12 -154.94 6.27 Favored Glycine 0 C--N 1.288 -2.111 0 C-N-CA 119.274 -1.441 . . . . 0.0 111.744 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.5 m -116.57 137.94 51.79 Favored 'General case' 0 C--N 1.29 -2.006 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 t -134.35 154.69 51.2 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.104 0.478 . . . . 0.0 110.539 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -87.63 -12.8 44.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.355 0.598 . . . . 0.0 109.397 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.0 m -134.16 165.54 24.84 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.099 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 28.0 t -107.16 117.18 33.39 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 120.684 0.278 . . . . 0.0 110.945 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.4 t -82.44 117.16 22.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 173.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -94.55 57.81 2.28 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.847 1.308 . . . . 0.0 111.603 -175.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.2 p -108.29 172.28 6.93 Favored 'General case' 0 N--CA 1.413 -2.304 0 CA-C-N 114.181 -1.372 . . . . 0.0 107.929 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -87.88 -26.19 22.88 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.205 177.158 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -72.95 -39.62 66.05 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -114.98 119.3 36.02 Favored 'General case' 0 N--CA 1.422 -1.836 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -107.47 149.27 28.13 Favored 'General case' 0 C--N 1.287 -2.124 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.8 p -122.53 145.37 48.39 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.5 p -140.49 149.19 42.2 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -122.4 71.55 1.02 Allowed 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 121.766 0.793 . . . . 0.0 109.932 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.503 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 6.9 m -149.33 151.49 34.23 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -67.42 131.95 46.68 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.423 ' HG2' HG21 ' A' ' 9' ' ' VAL . 49.9 mtm180 65.12 21.97 12.24 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.706 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 27.7 p -73.87 -25.83 60.25 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.9 p-10 -88.24 50.84 2.05 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.276 1.036 . . . . 0.0 111.274 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.486 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 50.6 pttt . . . . . 0 C--N 1.306 -1.308 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.644 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.411 HD13 ' SG ' ' A' ' 19' ' ' CYS . 28.3 mt . . . . . 0 CA--C 1.49 -1.332 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -109.72 108.92 19.47 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.304 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.513 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 79.4 m -134.01 164.96 26.14 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.07 -173.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -84.07 81.43 8.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.417 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 57.9 tt0 -79.59 -41.62 26.72 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 121.732 0.777 . . . . 0.0 110.697 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -106.92 20.12 19.48 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 121.706 0.765 . . . . 0.0 109.871 -177.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 -24.82 14.55 Favored Glycine 0 CA--C 1.499 -0.968 0 N-CA-C 110.041 -1.223 . . . . 0.0 110.041 -176.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -105.07 158.91 16.24 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.58 121.09 22.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 O-C-N 123.634 0.584 . . . . 0.0 110.178 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.9 m -130.76 151.65 36.26 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.7 m -83.44 115.97 22.3 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.4 m -74.12 154.71 39.03 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -77.57 170.42 16.61 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 118.42 0.555 . . . . 0.0 109.792 -176.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -62.73 -25.33 68.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.187 0.595 . . . . 0.0 111.126 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -69.16 -30.78 69.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.489 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -82.89 105.29 13.78 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.591 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -94.95 -14.92 24.0 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.85 -178.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -131.21 145.35 51.89 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.34 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.411 ' SG ' HD13 ' A' ' 1' ' ' LEU . 62.3 m -109.8 133.16 53.46 Favored 'General case' 0 C--N 1.272 -2.776 0 N-CA-C 104.871 -2.27 . . . . 0.0 104.871 171.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 51.4 p90 -116.06 146.36 42.26 Favored 'General case' 0 N--CA 1.42 -1.943 0 C-N-CA 118.702 -1.199 . . . . 0.0 112.551 -177.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 56' ' ' ASN . 21.9 t-160 -124.83 102.3 7.49 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.108 -1.405 . . . . 0.0 107.639 177.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.472 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 3.3 t-20 -88.5 118.54 28.22 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 174.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.7 p -82.6 -22.11 34.92 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 123.808 0.693 . . . . 0.0 110.655 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.47 -146.75 49.11 Favored Glycine 0 N--CA 1.429 -1.807 0 N-CA-C 109.099 -1.6 . . . . 0.0 109.099 -176.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 26.5 mmt -116.82 154.88 49.57 Favored Pre-proline 0 C--N 1.279 -2.461 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 174.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -63.08 112.03 1.57 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 121.524 1.483 . . . . 0.0 110.91 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 34.4 m-85 -116.13 140.24 49.5 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.407 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -62.51 107.49 0.95 Allowed 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.908 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 59.75 24.53 13.46 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.522 1.129 . . . . 0.0 111.167 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.77 113.02 14.19 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 121.328 0.585 . . . . 0.0 109.852 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -97.71 98.55 9.96 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -80.8 106.69 13.0 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 33' ' ' ILE . 17.0 mm -117.32 118.26 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.915 0 CA-C-O 121.956 0.884 . . . . 0.0 113.312 -175.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.472 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 6.2 mp -123.05 77.53 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.291 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.417 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 27.2 mt-30 -99.27 116.22 30.94 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.023 -0.989 . . . . 0.0 108.689 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.533 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -144.8 -173.37 16.04 Favored Glycine 0 CA--C 1.479 -2.162 0 C-N-CA 119.65 -1.262 . . . . 0.0 111.803 -179.191 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.3 m -113.5 138.13 50.56 Favored 'General case' 0 C--N 1.287 -2.144 0 N-CA-C 106.329 -1.73 . . . . 0.0 106.329 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -132.5 153.24 51.11 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 t -83.91 -46.05 12.54 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -113.87 -177.03 3.03 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.3 t -140.47 129.57 23.53 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.4 m -91.3 100.28 13.11 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 167.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.93 117.55 7.76 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.751 0.786 . . . . 0.0 112.799 -171.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.5 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 1.4 p -149.63 170.21 19.2 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.127 177.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -97.77 -18.49 18.76 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.465 0.65 . . . . 0.0 109.634 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -83.5 -27.69 29.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.108 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.5 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -118.17 95.41 4.88 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.566 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 79.7 tttt -79.0 108.25 12.34 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.481 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 28.5 p -100.12 119.85 38.96 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.5 p -130.68 155.96 45.72 Favored 'General case' 0 C--N 1.275 -2.661 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -115.11 21.61 14.07 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -112.77 151.54 30.2 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -65.16 134.89 54.7 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 110.538 -0.171 . . . . 0.0 110.538 -176.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 58.77 23.25 10.98 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.485 1.116 . . . . 0.0 113.029 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.7 p -71.09 -19.5 62.45 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 121.183 0.516 . . . . 0.0 111.472 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.513 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.5 p-10 -90.23 69.41 7.13 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 122.544 1.164 . . . . 0.0 110.998 -178.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttp . . . . . 0 N--CA 1.428 -1.535 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.691 -179.3 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.43 HD13 ' SG ' ' A' ' 19' ' ' CYS . 18.5 mt . . . . . 0 CA--C 1.487 -1.462 0 CA-C-O 121.037 0.446 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -110.38 113.67 26.51 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 5.5 m -123.87 164.18 19.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -172.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.412 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 81.6 m-85 -84.87 84.02 7.85 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -71.7 -42.42 67.4 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.19 -1.004 . . . . 0.0 110.584 178.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -106.02 7.12 31.77 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.56 0.695 . . . . 0.0 109.704 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.38 -14.58 63.3 Favored Glycine 0 C--N 1.31 -0.876 0 N-CA-C 107.926 -2.07 . . . . 0.0 107.926 -170.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.2 mttm -104.96 150.75 24.65 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.3 t -73.23 122.2 25.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 123.744 0.653 . . . . 0.0 110.384 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.8 m -121.57 151.07 24.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -84.01 113.34 20.93 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.5 m -83.77 143.5 29.93 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -65.95 169.5 6.65 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.225 0.466 . . . . 0.0 110.759 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -63.81 -9.78 16.62 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 124.295 1.038 . . . . 0.0 113.09 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -82.73 -29.0 30.07 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.439 ' HA ' ' HA ' ' A' ' 39' ' ' SER . 1.3 mpt? -81.98 101.65 10.44 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.529 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.09 -6.61 31.34 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.566 -177.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -134.8 148.61 50.23 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.267 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.43 ' SG ' HD13 ' A' ' 1' ' ' LEU . 25.3 m -99.77 137.18 38.6 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 171.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -112.35 147.29 36.68 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 118.173 -1.411 . . . . 0.0 111.313 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -126.7 101.57 6.68 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 114.515 -1.22 . . . . 0.0 107.823 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.554 HD22 ' HB2' ' A' ' 47' ' ' ASN . 25.2 t-20 -101.07 115.01 29.49 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 175.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.5 p -79.38 -27.86 41.9 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.094 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.38 -146.66 49.08 Favored Glycine 0 N--CA 1.427 -1.912 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.291 178.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 69.5 mtm -90.91 138.21 26.31 Favored Pre-proline 0 C--N 1.292 -1.892 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.9 123.96 9.31 Favored 'Trans proline' 0 C--O 1.252 1.185 0 C-N-CA 122.465 2.11 . . . . 0.0 110.851 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.457 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 61.1 m-85 -123.84 143.33 50.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.328 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -71.05 114.43 9.09 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.698 -176.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 67.1 t30 66.33 26.51 10.26 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.9 1.28 . . . . 0.0 110.07 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.457 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 3.1 tm? -130.87 129.08 41.84 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -102.29 94.89 5.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.493 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.7 tp -78.17 109.58 12.4 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.197 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.6 mm -113.55 101.65 12.77 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.646 0 CA-C-O 121.347 0.594 . . . . 0.0 111.671 -176.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.46 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 9.6 mp -109.64 61.48 0.6 Allowed 'General case' 0 C--N 1.306 -1.325 0 CA-C-O 122.269 1.033 . . . . 0.0 108.794 171.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -96.71 130.39 43.95 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.63 -160.41 8.76 Favored Glycine 0 C--N 1.278 -2.668 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.938 178.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 m -119.87 135.99 54.66 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.8 t -133.72 150.85 51.51 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.255 0.55 . . . . 0.0 110.82 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 16' ' ' MET . 13.1 t -77.17 -45.47 26.59 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.385 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.5 m -119.69 -175.79 3.03 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 43.2 t -125.46 138.69 54.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.003 0.43 . . . . 0.0 110.62 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.3 p -88.88 173.51 8.48 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 123.482 0.713 . . . . 0.0 110.652 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -91.92 17.73 8.83 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.112 0.482 . . . . 0.0 111.011 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.44 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 7.8 p -82.38 146.03 29.58 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.741 -175.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.08 -26.2 14.3 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -74.58 -27.16 60.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.554 ' HB2' HD22 ' A' ' 22' ' ' ASN . 8.9 t30 -115.81 96.75 5.75 Favored 'General case' 0 N--CA 1.416 -2.142 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 174.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -87.82 154.28 20.67 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.131 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 31.5 p -130.03 142.68 50.59 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 p -140.21 147.52 40.19 Favored 'General case' 0 C--N 1.278 -2.523 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 26.0 t -116.93 68.49 0.74 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.925 0.869 . . . . 0.0 110.968 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.0 m -148.78 144.99 27.37 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -69.54 130.59 42.87 Favored 'General case' 0 C--N 1.287 -2.129 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.499 -177.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.4 mtp-105 69.19 26.4 5.48 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.599 1.159 . . . . 0.0 111.524 -178.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 28.4 p -78.71 -26.37 44.83 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 178.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.431 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 32.3 p-10 -83.45 70.61 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.839 1.304 . . . . 0.0 110.044 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.428 -1.541 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.896 -172.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.428 HD13 ' SG ' ' A' ' 19' ' ' CYS . 19.5 mt . . . . . 0 CA--C 1.478 -1.807 0 CA-C-O 120.556 0.217 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 10.5 ptpp? -109.23 112.34 24.44 Favored 'General case' 0 N--CA 1.414 -2.238 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 174.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 74.0 m -136.26 165.06 26.64 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.197 -175.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.441 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 92.7 m-85 -82.02 63.0 6.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.415 0.626 . . . . 0.0 110.611 -176.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.515 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 52.8 tt0 -70.61 -31.99 69.17 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.927 -175.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -106.21 -7.36 17.9 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 122.155 0.979 . . . . 0.0 109.297 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.39 -18.07 30.61 Favored Glycine 0 C--N 1.305 -1.146 0 N-CA-C 108.099 -2.001 . . . . 0.0 108.099 -171.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 62.2 mttp -104.76 155.54 18.79 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.538 -1.331 . . . . 0.0 107.649 175.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.8 t -73.18 108.24 4.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.46 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 29.5 m -123.54 151.04 27.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 94.6 m -82.37 108.18 15.6 Favored 'General case' 0 N--CA 1.418 -2.073 0 CA-C-O 121.475 0.655 . . . . 0.0 109.524 176.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 58.3 m -76.7 136.94 39.11 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 176.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -57.21 162.35 2.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.568 0.747 . . . . 0.0 111.227 -172.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -62.33 -17.42 58.8 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -176.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 39' ' ' SER . 7.0 m-20 -71.01 -30.35 66.56 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.756 0.789 . . . . 0.0 109.117 176.231 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -79.03 101.41 7.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.451 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -91.92 -22.19 20.18 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.028 -178.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -127.42 137.31 52.69 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.479 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.428 ' SG ' HD13 ' A' ' 1' ' ' LEU . 60.2 m -103.49 127.82 50.81 Favored 'General case' 0 C--N 1.279 -2.468 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -109.57 159.73 16.84 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.767 -0.773 . . . . 0.0 111.948 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.417 ' NE2' ' HB ' ' A' ' 23' ' ' THR . 7.8 t-160 -129.99 101.46 5.85 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.859 177.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.558 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.0 t-20 -101.36 118.23 36.56 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.417 ' HB ' ' NE2' ' A' ' 21' ' ' HIS . 8.9 t -118.63 134.66 54.95 Favored 'General case' 0 C--N 1.287 -2.122 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.063 -177.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.37 171.88 48.33 Favored Glycine 0 N--CA 1.432 -1.578 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 176.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 64.4 mtt -75.9 147.04 80.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.83 106.08 0.6 Allowed 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 122.401 2.067 . . . . 0.0 112.892 -178.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.444 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 56.1 m-85 -121.97 144.34 48.94 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -58.18 121.64 11.21 Favored 'General case' 0 C--O 1.242 0.709 0 O-C-N 123.402 0.439 . . . . 0.0 110.578 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 69.05 7.68 6.38 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.682 1.193 . . . . 0.0 112.502 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 59.6 tp -126.95 102.88 7.19 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.103 0.477 . . . . 0.0 110.654 -178.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -110.64 98.98 8.02 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 tp -93.61 106.13 18.12 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.263 0.554 . . . . 0.0 109.58 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.431 HG23 ' HG3' ' A' ' 35' ' ' GLN . 15.4 mm -123.69 112.21 32.24 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.264 178.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.558 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.1 mt -119.83 70.55 0.86 Allowed 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 121.691 0.758 . . . . 0.0 109.203 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.431 ' HG3' HG23 ' A' ' 33' ' ' ILE . 26.2 mt-30 -86.06 118.73 25.71 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 173.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.515 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -139.53 -160.17 8.25 Favored Glycine 0 N--CA 1.425 -2.042 0 C-N-CA 120.002 -1.094 . . . . 0.0 112.506 -175.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 74.1 m -135.13 135.75 41.37 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 t -133.78 156.56 47.78 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 121.305 0.574 . . . . 0.0 110.836 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 18.2 m -76.59 -33.47 58.44 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.082 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.1 m -141.92 139.31 32.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.64 165.41 11.45 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.4 p -95.6 169.17 10.22 Favored 'General case' 0 N--CA 1.42 -1.94 0 C-N-CA 124.5 1.12 . . . . 0.0 110.566 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -93.34 27.93 2.4 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.612 0.72 . . . . 0.0 110.144 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.483 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.7 p -74.88 144.15 43.5 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.678 -178.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.39 -29.34 18.09 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -73.08 -44.34 60.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.102 176.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.483 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -93.15 99.17 11.8 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 176.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -89.29 151.61 22.01 Favored 'General case' 0 C--N 1.282 -2.327 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.5 -174.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.0 p -147.16 144.49 29.02 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.7 p -139.51 155.51 47.49 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 114.49 -1.232 . . . . 0.0 107.822 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -113.63 32.77 5.58 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.1 m -119.95 150.4 40.56 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -65.69 129.92 41.48 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.533 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 61.81 27.09 16.51 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.491 -1.232 . . . . 0.0 112.577 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 30.1 p -77.56 -25.14 49.8 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.446 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.538 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -83.59 73.8 10.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 122.947 1.356 . . . . 0.0 110.315 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.294 -1.832 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.271 -177.044 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.414 HD13 ' SG ' ' A' ' 19' ' ' CYS . 30.8 mt . . . . . 0 CA--C 1.488 -1.423 0 CA-C-O 121.203 0.525 . . . . 0.0 111.905 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HB2' ' CG1' ' A' ' 9' ' ' VAL . 20.3 pttp -110.77 113.95 26.93 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.203 172.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.49 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 85.0 m -135.82 164.02 28.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.274 0.559 . . . . 0.0 112.212 -174.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -81.39 85.02 6.51 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 122.129 -0.357 . . . . 0.0 111.324 -174.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 63.8 tt0 -81.4 -43.2 19.31 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.754 -1.178 . . . . 0.0 112.103 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -107.0 19.35 20.57 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.578 0.704 . . . . 0.0 111.259 -178.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.13 -38.05 3.46 Favored Glycine 0 CA--C 1.497 -1.049 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 -176.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -100.5 163.44 12.36 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.406 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 41.0 t -72.86 132.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 O-C-N 123.557 0.536 . . . . 0.0 111.244 -176.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -126.41 152.09 33.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 174.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.45 120.46 29.84 Favored 'General case' 0 C--N 1.283 -2.317 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.947 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.4 m -80.47 143.88 33.01 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -74.07 169.35 17.68 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.11 -7.59 42.73 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.8 -29.64 56.08 Favored 'General case' 0 CA--C 1.495 -1.141 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -77.91 126.52 30.97 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.326 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -108.18 -24.92 11.32 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.156 -175.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -133.73 143.63 48.6 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.204 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.414 ' SG ' HD13 ' A' ' 1' ' ' LEU . 61.6 m -102.56 119.9 39.62 Favored 'General case' 0 C--N 1.278 -2.51 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 170.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.9 p90 -99.59 149.53 23.17 Favored 'General case' 0 N--CA 1.42 -1.926 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.811 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.439 ' CE1' ' HB ' ' A' ' 23' ' ' THR . 6.0 t60 -125.73 101.82 7.04 Favored 'General case' 0 C--N 1.278 -2.523 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.855 178.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.452 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.3 t30 -110.3 106.91 16.47 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.439 ' HB ' ' CE1' ' A' ' 21' ' ' HIS . 10.2 t -100.37 170.89 8.11 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.69 -165.17 29.32 Favored Glycine 0 C--N 1.3 -1.446 0 C-N-CA 119.738 -1.22 . . . . 0.0 111.047 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 86.1 mtp -74.06 133.48 78.53 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.4 104.47 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.902 1.735 . . . . 0.0 112.975 -176.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -133.21 143.67 49.3 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 114.865 -1.062 . . . . 0.0 108.444 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.497 ' HA ' ' NE ' ' A' ' 28' ' ' ARG . 2.0 mmp_? -70.79 129.82 40.09 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 73.69 17.05 3.75 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.652 1.181 . . . . 0.0 111.201 -176.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.79 91.58 3.59 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -104.04 105.14 15.22 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 68.0 tp -104.54 106.69 17.28 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 mm -103.66 103.39 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.094 0 CA-C-O 121.809 0.814 . . . . 0.0 111.147 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 84.2 mt -123.58 63.53 1.03 Allowed 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 170.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.533 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 91.2 mt-30 -109.5 114.95 29.01 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.974 -1.467 . . . . 0.0 107.247 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.55 -170.72 13.97 Favored Glycine 0 C--N 1.286 -2.209 0 C-N-CA 119.314 -1.422 . . . . 0.0 112.174 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 20.8 m -111.44 132.14 54.69 Favored 'General case' 0 C--N 1.285 -2.219 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -133.85 154.32 51.11 Favored 'General case' 0 C--N 1.302 -1.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.755 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -86.69 -11.3 51.63 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.358 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.5 m -141.47 -169.05 2.79 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.7 t -148.7 151.55 35.11 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.7 t -114.03 110.48 20.11 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 170.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -70.81 97.33 1.37 Allowed 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 122.825 1.298 . . . . 0.0 111.273 -176.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.401 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 24.9 p -135.91 178.15 7.28 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.962 -176.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -94.95 -28.21 15.28 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.344 0.592 . . . . 0.0 109.752 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -88.3 -36.6 16.58 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.401 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.5 t30 -102.76 106.08 16.63 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -94.07 153.67 18.02 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.146 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.2 m -132.31 124.84 29.61 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.6 p -129.59 147.11 51.35 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -114.48 25.67 10.84 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.5 m -114.05 147.02 39.4 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -66.87 133.04 49.26 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.4 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 66.19 18.77 11.02 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 124.83 1.252 . . . . 0.0 112.693 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.5 p -65.35 -31.87 73.22 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.101 0.477 . . . . 0.0 111.685 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.522 HD22 ' HB3' ' A' ' 35' ' ' GLN . 36.9 p-10 -83.87 47.51 1.31 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.175 0.988 . . . . 0.0 111.107 -176.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt . . . . . 0 C--O 1.249 1.054 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.011 178.884 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.472 HD13 ' SG ' ' A' ' 19' ' ' CYS . 33.9 mt . . . . . 0 CA--C 1.472 -2.048 0 CA-C-O 120.712 0.291 . . . . 0.0 110.915 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.45 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 23.3 pttm -109.04 106.68 16.72 Favored 'General case' 0 N--CA 1.411 -2.409 0 CA-C-O 121.615 0.722 . . . . 0.0 109.121 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 85.3 m -131.07 166.14 21.71 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.83 -174.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -77.37 74.3 3.93 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.458 ' HA ' ' HA2' ' A' ' 36' ' ' GLY . 16.1 tm0? -85.85 -42.04 14.47 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.669 0.747 . . . . 0.0 109.337 178.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -100.42 20.46 14.83 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 122.329 1.061 . . . . 0.0 108.939 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.54 -35.66 3.79 Favored Glycine 0 CA--C 1.496 -1.141 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -176.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -104.46 163.13 12.67 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.9 t -68.09 114.37 4.87 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 123.893 0.746 . . . . 0.0 109.043 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 35.8 m -128.85 151.98 36.38 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.445 -177.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.7 m -76.3 106.27 7.82 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.0 m -79.49 144.62 33.82 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -63.68 167.77 5.51 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.331 0.652 . . . . 0.0 112.466 -170.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -55.53 -23.31 25.73 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 125.064 1.346 . . . . 0.0 112.595 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 39' ' ' SER . 15.7 m-20 -84.35 -26.62 28.31 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -175.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -74.32 101.67 4.12 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.25 -177.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.414 ' HG3' ' O ' ' A' ' 15' ' ' ASP . 47.1 mttp -94.42 -22.83 18.05 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.01 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -128.39 148.41 50.69 Favored 'General case' 0 N--CA 1.429 -1.525 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.369 -173.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.472 ' SG ' HD13 ' A' ' 1' ' ' LEU . 57.3 m -106.32 136.22 46.44 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 104.565 -2.383 . . . . 0.0 104.565 170.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 43.4 p90 -125.59 152.98 44.38 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.87 -174.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -130.4 102.61 6.25 Favored 'General case' 0 N--CA 1.421 -1.904 0 CA-C-N 113.886 -1.506 . . . . 0.0 107.007 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.601 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 5.0 t30 -90.27 102.29 15.02 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.0 p -67.85 -43.34 79.71 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.228 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.34 -152.52 41.66 Favored Glycine 0 N--CA 1.424 -2.121 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -176.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.471 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.2 mpp? -85.13 142.36 38.31 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.66 114.92 3.29 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.098 1.866 . . . . 0.0 109.947 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.471 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 52.3 m-85 -117.47 140.66 49.31 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 121.567 0.698 . . . . 0.0 110.614 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -91.87 127.88 37.5 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.726 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 65.9 t30 68.75 22.39 7.39 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.357 1.063 . . . . 0.0 110.064 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.1 tp -143.52 135.07 26.25 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.63 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -110.06 99.5 8.58 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.097 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -81.1 106.12 12.85 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 176.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.447 HD13 ' HA ' ' A' ' 33' ' ' ILE . 23.0 mm -112.15 115.01 48.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 CA-C-O 121.637 0.732 . . . . 0.0 112.74 -174.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.601 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 81.8 mt -133.94 72.84 1.48 Allowed 'General case' 0 N--CA 1.423 -1.808 0 CA-C-N 113.72 -1.582 . . . . 0.0 107.436 172.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -112.89 110.0 19.8 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.935 -177.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.458 ' HA2' ' HA ' ' A' ' 5' ' ' GLN . . . -145.19 -154.34 6.12 Favored Glycine 0 C--N 1.295 -1.75 0 C-N-CA 119.707 -1.235 . . . . 0.0 112.582 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.1 m -126.96 136.16 51.88 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 175.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.421 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 41.2 t -122.34 144.25 49.13 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.557 0.694 . . . . 0.0 111.663 -173.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 15.9 m -86.14 -30.2 22.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.724 178.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.2 m -142.19 104.27 4.42 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.0 t -116.52 136.85 52.64 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.634 -167.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.4 m -96.45 105.55 17.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.63 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.417 ' HG2' ' HB2' ' A' ' 49' ' ' CYS . 34.3 mt-10 -66.46 104.95 1.35 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.598 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -137.8 175.05 9.94 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.86 -36.52 64.87 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -63.76 -59.91 3.97 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.073 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.457 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 8.0 t30 -106.45 105.01 14.84 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.271 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 39.2 ttpt -86.22 116.71 24.57 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.17 -178.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.417 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 20.7 m -104.75 132.55 50.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.297 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.2 p -139.92 155.6 47.09 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.4 p -126.62 72.71 1.35 Allowed 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.819 0.819 . . . . 0.0 111.73 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.479 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 4.6 m -149.35 151.29 33.87 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 175.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.45 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 11.3 m-20 -66.86 126.08 27.93 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -177.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 69.93 18.88 7.16 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.499 1.52 . . . . 0.0 112.689 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.479 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.5 p -70.4 -20.35 62.94 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -176.08 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 28.9 p-10 -89.52 33.77 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.553 0.692 . . . . 0.0 110.786 -177.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 C--N 1.314 -0.935 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.574 -179.266 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 1' ' ' LEU . 21.5 mt . . . . . 0 CA--C 1.497 -1.09 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 11' ' ' THR . 21.8 pttp -110.91 116.18 30.79 Favored 'General case' 0 C--N 1.278 -2.518 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 169.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.5 m -133.78 165.22 25.48 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-O 121.125 0.488 . . . . 0.0 111.567 -172.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.569 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.6 m-85 -83.65 86.57 7.1 Favored 'General case' 0 C--O 1.189 -2.087 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 -174.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -76.88 -41.48 43.6 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.033 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -105.85 12.17 31.05 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.555 -177.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.77 -10.53 72.0 Favored Glycine 0 CA--C 1.517 0.217 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -171.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.535 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.3 mttt -105.51 153.29 21.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 28.0 t -76.93 108.89 10.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 O-C-N 123.316 0.385 . . . . 0.0 110.152 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.4 m -123.85 151.26 28.59 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 25.8 m -82.75 129.25 34.95 Favored 'General case' 0 C--N 1.285 -2.218 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -178.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 60.4 m -74.05 158.08 34.93 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.611 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 20.9 t-80 -70.71 165.53 22.79 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 -176.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -68.59 3.73 1.71 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -176.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.71 -12.75 15.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.552 0.692 . . . . 0.0 109.332 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.611 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -86.9 117.2 25.48 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.703 -172.033 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -104.57 -21.54 13.41 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.344 -1.298 . . . . 0.0 109.907 -177.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -128.86 150.0 50.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.84 -177.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 64.9 m -109.26 136.87 48.01 Favored 'General case' 0 C--N 1.276 -2.611 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -120.54 152.82 37.57 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.051 -176.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -134.68 101.87 5.09 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.547 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 5.2 t30 -97.74 104.7 16.75 Favored 'General case' 0 CA--C 1.485 -1.532 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.3 p -66.14 -36.47 83.22 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 123.797 0.686 . . . . 0.0 112.131 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.63 -132.09 29.36 Favored Glycine 0 N--CA 1.427 -1.945 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.39 124.28 36.22 Favored Pre-proline 0 C--N 1.282 -2.334 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -79.07 120.02 4.46 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.545 2.164 . . . . 0.0 111.37 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.459 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 96.9 m-85 -117.16 142.96 46.36 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -66.88 125.68 26.68 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.972 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 68.13 21.97 8.47 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.815 1.246 . . . . 0.0 111.586 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.459 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 54.7 tp -141.25 103.04 4.35 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.339 0.59 . . . . 0.0 111.092 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -83.75 98.25 9.58 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 tt -77.17 106.4 8.86 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 177.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.411 HG23 ' HG3' ' A' ' 35' ' ' GLN . 26.1 mm -104.57 111.26 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.743 -172.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.547 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 62.0 mt -126.28 59.33 1.34 Allowed 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.192 -1.367 . . . . 0.0 108.057 172.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.411 ' HG3' HG23 ' A' ' 33' ' ' ILE . 53.9 mt-30 -93.5 125.38 38.08 Favored 'General case' 0 N--CA 1.421 -1.898 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 176.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.4 -163.61 10.49 Favored Glycine 0 C--N 1.27 -3.124 0 C-N-CA 119.204 -1.475 . . . . 0.0 112.961 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 60.9 m -131.49 134.94 46.66 Favored 'General case' 0 C--N 1.286 -2.185 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 t -134.01 162.45 32.04 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.317 0.58 . . . . 0.0 110.217 -176.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -90.82 -15.73 29.53 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 177.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.4 m -132.7 -171.26 2.62 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.359 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.8 t -121.66 165.52 15.63 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.9 p -80.39 165.1 22.56 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 123.73 0.812 . . . . 0.0 112.007 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -85.83 -20.84 28.54 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.934 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 t -99.47 156.5 17.0 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.843 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -89.47 -15.61 32.69 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 123.972 0.795 . . . . 0.0 109.465 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -58.19 -32.12 67.95 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 122.618 1.199 . . . . 0.0 109.019 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 6.4 t30 -105.58 113.95 27.82 Favored 'General case' 0 N--CA 1.409 -2.502 0 CA-C-N 113.508 -1.678 . . . . 0.0 107.788 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -89.08 142.27 27.78 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.1 p -124.7 135.71 53.27 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.1 p -139.92 156.65 46.57 Favored 'General case' 0 C--N 1.269 -2.906 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 p -117.72 29.12 8.02 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -173.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.0 m -129.14 154.43 46.73 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.059 0.457 . . . . 0.0 110.985 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -50.98 124.51 11.48 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.06 0.944 . . . . 0.0 112.363 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 58.29 27.43 15.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.579 1.151 . . . . 0.0 113.68 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.2 p -76.59 -25.12 53.6 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -87.31 33.67 0.69 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -171.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.569 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 14.4 ptmm? . . . . . 0 C--N 1.302 -1.471 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.457 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.433 HD13 ' SG ' ' A' ' 19' ' ' CYS . 27.7 mt . . . . . 0 CA--C 1.479 -1.769 0 CA-C-O 121.574 0.702 . . . . 0.0 111.773 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 47.4 pttt -109.75 108.56 18.96 Favored 'General case' 0 C--N 1.28 -2.449 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.843 174.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.544 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 71.9 m -133.23 165.12 25.54 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.788 -173.059 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.46 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 91.8 m-85 -81.98 74.19 8.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.237 0.541 . . . . 0.0 110.623 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 43.6 tt0 -85.04 -35.83 21.63 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-O 121.444 0.64 . . . . 0.0 112.103 -177.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -105.81 9.44 32.91 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 122.26 1.029 . . . . 0.0 108.336 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 103.39 -38.33 3.28 Favored Glycine 0 CA--C 1.498 -1.009 0 N-CA-C 108.252 -1.939 . . . . 0.0 108.252 -174.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -93.05 162.81 13.89 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 113.925 -1.137 . . . . 0.0 108.217 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.406 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 57.6 t -71.77 123.2 25.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 16.5 m -120.48 152.12 23.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.67 103.02 15.54 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.7 m -82.43 142.06 32.25 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -69.66 170.88 9.95 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.4 mtm180 -76.32 -4.16 40.64 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -69.26 -31.62 70.27 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 171.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -82.14 101.32 10.35 Favored 'General case' 0 N--CA 1.422 -1.839 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.853 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -102.37 -8.27 21.32 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.278 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -134.71 136.11 42.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.257 -178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.433 ' SG ' HD13 ' A' ' 1' ' ' LEU . 82.9 m -101.69 136.41 41.57 Favored 'General case' 0 C--N 1.28 -2.447 0 N-CA-C 105.25 -2.129 . . . . 0.0 105.25 170.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.411 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 51.3 p90 -120.72 147.35 45.41 Favored 'General case' 0 C--N 1.293 -1.852 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.335 -176.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.659 ' CE1' ' HB ' ' A' ' 23' ' ' THR . 1.7 t60 -120.21 102.31 8.41 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.564 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 6.3 t30 -104.64 102.82 12.4 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.659 ' HB ' ' CE1' ' A' ' 21' ' ' HIS . 9.9 t -102.04 -162.96 0.97 Allowed 'General case' 0 C--N 1.273 -2.72 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.551 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.32 -102.68 0.27 Allowed Glycine 0 N--CA 1.416 -2.66 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.1 mtt -128.38 157.84 73.37 Favored Pre-proline 0 C--N 1.285 -2.228 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.65 105.46 1.1 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.4 1.4 . . . . 0.0 110.224 176.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -91.21 143.69 26.4 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.115 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.67 118.0 20.35 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.115 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 66.32 18.91 10.99 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.921 0.888 . . . . 0.0 111.735 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.0 tp -145.67 132.14 19.73 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -117.53 106.35 13.05 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 66.3 tp -80.96 106.22 12.79 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.467 HG23 ' HG3' ' A' ' 35' ' ' GLN . 25.1 mm -115.24 96.52 4.68 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.142 -177.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.564 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 84.2 mt -106.77 61.32 0.63 Allowed 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 173.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 88.5 mt-30 -97.93 120.13 37.77 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.533 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -145.84 -163.3 10.19 Favored Glycine 0 C--N 1.284 -2.325 0 C-N-CA 119.813 -1.184 . . . . 0.0 112.636 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.484 ' H ' ' NE2' ' A' ' 5' ' ' GLN . 74.0 m -122.17 137.68 54.74 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 173.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -133.68 157.43 45.83 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 t -81.37 -43.25 19.27 Favored 'General case' 0 N--CA 1.416 -2.127 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.0 p -105.58 178.85 4.44 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.9 t -120.52 126.65 50.89 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.491 0.186 . . . . 0.0 110.906 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.1 m -82.0 85.33 6.74 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.31 99.97 0.77 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.639 1.209 . . . . 0.0 113.023 -173.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.403 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 9.4 p -148.82 175.74 10.99 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-N 113.012 -1.904 . . . . 0.0 107.006 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -89.86 -32.55 16.84 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.052 0.454 . . . . 0.0 110.968 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -79.31 -36.91 38.86 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.807 0.337 . . . . 0.0 111.4 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.403 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 7.1 t30 -94.31 99.58 11.78 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 174.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -89.99 114.53 26.39 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.516 -174.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 32.0 p -104.2 136.02 44.59 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.38 176.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.7 p -139.54 155.6 47.41 Favored 'General case' 0 C--N 1.282 -2.361 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.997 -179.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -112.3 25.83 11.15 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.409 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 1.7 m -116.36 148.53 40.53 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -66.02 126.05 27.38 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 120.734 0.302 . . . . 0.0 111.175 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 65.7 24.75 11.53 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 124.843 1.257 . . . . 0.0 112.396 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.409 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 26.1 p -70.92 -19.56 62.57 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.177 0.513 . . . . 0.0 111.863 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.544 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 36.4 p-10 -89.43 70.54 8.06 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 122.469 1.128 . . . . 0.0 110.522 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.46 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 22.0 pttp . . . . . 0 C--N 1.306 -1.32 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.971 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 34.7 mt . . . . . 0 CA--C 1.484 -1.564 0 CA-C-O 120.858 0.361 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -110.92 113.58 26.26 Favored 'General case' 0 N--CA 1.415 -2.186 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.6 m -128.5 164.22 23.26 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.447 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 89.9 m-85 -82.78 76.94 9.6 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 122.37 -0.206 . . . . 0.0 111.371 -177.253 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.546 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 59.0 tt0 -77.92 -42.37 33.37 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.509 0.671 . . . . 0.0 111.187 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -90.91 -2.26 57.75 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.06 -14.96 62.17 Favored Glycine 0 C--N 1.307 -1.079 0 N-CA-C 107.242 -2.343 . . . . 0.0 107.242 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.4 mttt -105.03 155.82 18.62 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.3 t -70.87 113.13 6.52 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.1 m -125.88 152.22 32.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 16.1 m -82.37 126.62 32.39 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-O 121.185 0.517 . . . . 0.0 110.227 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.9 m -82.74 153.63 25.19 Favored 'General case' 0 C--N 1.297 -1.707 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.426 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.8 t-80 -67.62 160.88 26.97 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -62.88 -12.55 25.72 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -176.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -81.89 -24.34 35.75 Favored 'General case' 0 CA--C 1.504 -0.818 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.426 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.3 OUTLIER -73.51 126.0 29.23 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.699 -172.909 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -113.19 -24.25 9.52 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.13 -175.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -130.43 148.56 52.26 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.074 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.9 m -96.26 142.52 28.32 Favored 'General case' 0 C--N 1.286 -2.153 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 169.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.442 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 45.5 p90 -123.17 154.53 38.57 Favored 'General case' 0 C--N 1.294 -1.811 0 C-N-CA 118.466 -1.293 . . . . 0.0 111.429 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -131.97 106.05 7.8 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 174.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.436 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 27.0 t-20 -97.08 133.29 41.94 Favored 'General case' 0 C--N 1.289 -2.058 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 175.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.65 -164.35 1.8 Allowed 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -163.97 -75.65 0.03 OUTLIER Glycine 0 CA--C 1.476 -2.378 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 178.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 88.0 mtp -137.55 157.56 73.55 Favored Pre-proline 0 C--N 1.274 -2.71 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 175.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.62 143.64 24.33 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.946 1.764 . . . . 0.0 109.536 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.418 ' CB ' ' HB3' ' A' ' 30' ' ' LEU . 83.6 m-85 -116.18 142.9 46.21 Favored 'General case' 0 C--N 1.281 -2.4 0 CA-C-O 121.303 0.573 . . . . 0.0 112.221 -178.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -65.98 104.64 1.16 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.204 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 71.31 19.43 5.34 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 124.564 1.145 . . . . 0.0 111.301 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.418 ' HB3' ' CB ' ' A' ' 27' ' ' PHE . 66.0 tp -126.89 105.16 8.44 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -81.83 92.44 6.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 tt -82.9 106.26 14.58 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 20.9 mm -124.01 96.78 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.614 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.91 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.436 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 10.1 mp -104.98 60.91 0.69 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 170.153 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.563 ' HB3' HD22 ' A' ' 56' ' ' ASN . 25.8 mt-30 -103.45 126.52 50.65 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.583 -1.189 . . . . 0.0 108.262 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.04 -158.14 7.52 Favored Glycine 0 C--N 1.265 -3.39 0 C-N-CA 119.713 -1.232 . . . . 0.0 111.227 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 27.0 m -128.32 134.52 48.91 Favored 'General case' 0 C--N 1.281 -2.383 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.0 t -133.6 157.26 46.18 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.299 0.571 . . . . 0.0 110.245 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -87.8 -15.77 35.97 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.015 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.8 t -141.35 174.15 10.81 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.7 t -113.95 148.95 36.0 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 t -92.0 161.44 14.79 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -90.93 -12.45 36.01 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.985 0.421 . . . . 0.0 110.91 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -79.37 144.02 34.55 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-O 121.013 0.435 . . . . 0.0 110.478 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -2.88 53.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.991 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -76.89 -17.44 58.94 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.686 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -120.93 104.66 9.99 Favored 'General case' 0 N--CA 1.428 -1.572 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 53.4 mtpt -84.64 125.44 32.48 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.381 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.1 m -110.85 134.62 52.38 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.5 p -139.99 144.08 36.81 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -113.89 49.25 1.0 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -138.55 147.19 42.79 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 106.136 -1.801 . . . . 0.0 106.136 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -66.95 136.37 55.24 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.058 -177.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 63.72 19.77 11.89 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.438 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.0 p -68.12 -26.99 66.07 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.971 0.415 . . . . 0.0 110.841 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.563 HD22 ' HB3' ' A' ' 35' ' ' GLN . 36.2 p-10 -82.81 55.14 2.93 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 122.934 1.349 . . . . 0.0 111.09 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt . . . . . 0 N--CA 1.43 -1.474 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.196 -179.508 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.555 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 35.9 mt . . . . . 0 CA--C 1.482 -1.665 0 CA-C-O 121.095 0.474 . . . . 0.0 111.635 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 22.9 pttm -109.93 112.51 24.57 Favored 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 172.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.555 ' SG ' ' HB3' ' A' ' 1' ' ' LEU . 3.6 m -129.63 163.99 24.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.025 0.44 . . . . 0.0 110.622 -170.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.521 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 93.1 m-85 -81.36 90.48 6.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.057 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -83.95 -42.78 15.91 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.189 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -106.48 14.69 26.86 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.587 0.708 . . . . 0.0 109.181 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.2 -16.41 61.36 Favored Glycine 0 C--N 1.31 -0.91 0 N-CA-C 108.634 -1.786 . . . . 0.0 108.634 -172.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 92.1 mttt -105.09 159.01 16.17 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 56.3 t -81.4 119.05 30.24 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 123.612 0.57 . . . . 0.0 110.366 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 18.2 m -118.74 151.66 20.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.286 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.1 m -85.06 110.7 19.13 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.194 0.521 . . . . 0.0 109.752 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.4 m -85.77 140.76 30.2 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.986 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -71.42 172.35 9.62 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.769 -171.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -66.9 -10.55 49.82 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.506 1.122 . . . . 0.0 112.576 -177.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.407 ' HB2' ' SD ' ' A' ' 16' ' ' MET . 2.9 m-20 -73.94 -31.3 62.99 Favored 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 174.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.407 ' SD ' ' HB2' ' A' ' 15' ' ' ASP . 0.9 OUTLIER -86.8 114.13 23.21 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.814 -175.285 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -102.45 -16.28 16.23 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.964 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -134.25 145.27 48.98 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.091 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.524 ' SG ' HD13 ' A' ' 1' ' ' LEU . 33.7 m -92.74 140.81 29.14 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 168.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.54 ' CD2' ' HB2' ' A' ' 38' ' ' SER . 47.8 p90 -127.08 145.26 50.8 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.222 -1.391 . . . . 0.0 111.959 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -120.99 101.14 7.48 Favored 'General case' 0 C--N 1.274 -2.695 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 172.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.583 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.4 t-20 -104.48 138.05 41.44 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.4 t -162.4 -172.49 3.19 Favored 'General case' 0 N--CA 1.402 -2.869 0 N-CA-C 106.056 -1.831 . . . . 0.0 106.056 -177.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -139.08 -142.83 4.33 Favored Glycine 0 CA--C 1.481 -2.078 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -178.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.2 mtt -87.39 156.7 53.75 Favored Pre-proline 0 C--N 1.289 -2.047 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.09 106.39 1.71 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 121.709 1.606 . . . . 0.0 111.372 176.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.446 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 47.8 m-85 -107.43 138.24 43.99 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.3 mtp180 -60.04 123.81 18.27 Favored 'General case' 0 C--N 1.319 -0.731 0 O-C-N 123.124 0.265 . . . . 0.0 110.839 -177.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 69.75 4.99 4.99 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.757 1.223 . . . . 0.0 113.365 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 63.8 tp -120.2 88.82 3.01 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-O 121.575 0.702 . . . . 0.0 109.976 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -87.55 87.63 7.45 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.629 ' H ' HD23 ' A' ' 32' ' ' LEU . 2.2 pt? -82.17 113.1 19.77 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 121.658 0.742 . . . . 0.0 110.385 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.7 mm -123.51 111.86 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.604 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.583 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 91.0 mt -124.64 67.98 1.09 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.002 175.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -94.1 112.7 24.54 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.496 177.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.95 -158.15 7.52 Favored Glycine 0 C--N 1.283 -2.382 0 C-N-CA 120.104 -1.046 . . . . 0.0 110.927 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.7 m -123.87 134.34 53.59 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 175.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.54 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 45.7 t -112.37 144.59 41.56 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.263 0.554 . . . . 0.0 111.173 -173.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.8 m -86.46 -35.08 19.87 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 114.986 -1.007 . . . . 0.0 108.381 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.9 p -149.73 122.05 8.42 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.485 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.9 t -79.72 148.36 31.56 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.1 m -89.3 116.01 27.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 173.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -66.55 99.27 0.57 Allowed 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 122.241 1.019 . . . . 0.0 112.717 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.658 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.1 p -141.94 179.34 6.93 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.072 -179.297 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -94.95 -52.23 4.33 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.358 -178.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -76.76 -25.83 53.88 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.249 -173.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.658 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t30 -81.61 105.21 12.58 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 57.8 mtpt -88.3 120.32 29.55 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.736 -174.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.2 m -121.8 126.26 48.39 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -139.9 155.43 47.19 Favored 'General case' 0 C--N 1.284 -2.264 0 C-N-CA 121.28 -0.168 . . . . 0.0 110.71 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -104.75 32.91 3.84 Favored 'General case' 0 CA--C 1.558 1.254 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -173.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.2 p -130.47 147.26 52.14 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 121.733 -0.604 . . . . 0.0 111.421 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.437 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 75.2 m-20 -57.13 133.94 55.45 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.185 -177.098 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 78.6 mtm180 64.14 16.19 9.84 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 125.049 1.34 . . . . 0.0 114.031 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 25.6 p -75.96 -14.28 60.24 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.172 -0.611 . . . . 0.0 112.249 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -87.34 30.62 0.78 Allowed 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.641 -0.662 . . . . 0.0 111.454 -176.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.517 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 13.5 ptmm? . . . . . 0 C--O 1.254 1.319 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.521 HD13 ' SG ' ' A' ' 19' ' ' CYS . 19.1 mt . . . . . 0 CA--C 1.486 -1.484 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 36.2 pttt -109.93 110.43 21.38 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.183 172.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.511 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 72.9 m -136.9 164.34 28.56 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.984 -175.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.435 ' CE2' ' HB3' ' A' ' 54' ' ' ARG . 82.7 m-85 -84.4 81.58 8.77 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -176.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.502 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.1 tt0 -84.74 -42.94 14.75 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.223 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -106.17 19.07 21.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 -177.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.48 -38.59 3.15 Favored Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.45 153.8 24.28 Favored 'General case' 0 N--CA 1.426 -1.639 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.2 t -69.73 111.58 3.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 13.0 m -111.31 152.04 13.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.7 m -89.12 117.38 28.07 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.4 m -74.35 156.38 37.15 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.117 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.681 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.9 t-80 -64.29 160.57 18.47 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.87 0.868 . . . . 0.0 110.695 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.44 ' HE ' ' HB2' ' A' ' 14' ' ' ARG . 17.6 mtm180 -53.17 -40.47 64.38 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.451 1.1 . . . . 0.0 109.522 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -79.86 -8.52 59.34 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.571 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.681 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.4 OUTLIER -92.37 101.38 13.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 121.717 0.77 . . . . 0.0 109.598 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -88.46 -19.49 26.42 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.17 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -135.05 155.46 50.71 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.521 ' SG ' HD13 ' A' ' 1' ' ' LEU . 86.3 m -113.47 145.78 40.63 Favored 'General case' 0 C--N 1.279 -2.486 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 171.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.1 p90 -124.61 150.59 45.81 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.421 -178.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.458 ' CE1' HD11 ' A' ' 33' ' ' ILE . 78.3 t60 -127.24 111.94 14.53 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 177.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -102.27 105.85 16.56 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.515 ' O ' ' HA ' ' A' ' 46' ' ' ASN . 12.8 t -153.46 159.98 42.45 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.86 -51.73 0.7 Allowed Glycine 0 CA--C 1.467 -2.947 0 N-CA-C 108.099 -2.0 . . . . 0.0 108.099 -177.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 19.0 ptp -74.6 128.27 85.89 Favored Pre-proline 0 C--N 1.287 -2.149 0 CA-C-N 113.675 -1.262 . . . . 0.0 108.6 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -83.37 150.28 13.34 Favored 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 122.616 2.21 . . . . 0.0 111.783 -178.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -127.61 134.64 49.67 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.494 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -111.26 134.37 52.9 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.823 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.67 19.93 11.7 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.394 1.078 . . . . 0.0 111.562 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.7 tp -168.33 149.35 4.93 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 tptt -128.5 87.84 2.65 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 173.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -87.35 111.24 20.88 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.458 HD11 ' CE1' ' A' ' 21' ' ' HIS . 5.8 tp -122.67 99.29 6.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 CA-C-O 121.669 0.747 . . . . 0.0 109.625 179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.1 mt -85.0 85.34 7.49 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.994 0.902 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.502 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 3.4 pt20 -116.59 107.73 15.08 Favored 'General case' 0 C--N 1.276 -2.602 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.393 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.22 -150.85 5.33 Favored Glycine 0 C--N 1.295 -1.7 0 C-N-CA 119.907 -1.14 . . . . 0.0 112.596 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.5 m -120.39 136.81 54.6 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.2 t -133.99 154.6 51.01 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 121.572 0.701 . . . . 0.0 111.229 -177.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.3 t -80.85 -20.99 41.12 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.491 177.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.1 p -127.64 170.21 12.92 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 120.763 0.316 . . . . 0.0 111.672 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 45.3 t -127.03 104.01 7.77 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 m -97.2 96.47 8.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -78.89 103.98 9.21 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.051 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.1 p -134.93 176.76 8.36 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -81.91 -28.82 32.64 Favored 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.0 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' A' ' 23' ' ' THR . 7.8 t30 -81.95 -47.24 12.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -103.11 106.45 16.97 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 94.6 mttt -101.57 120.17 39.9 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.919 -177.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 p -110.24 130.49 55.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.268 0.556 . . . . 0.0 111.49 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.0 p -139.42 156.5 46.93 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.062 0.945 . . . . 0.0 110.566 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.7 m -118.41 28.77 8.14 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.401 ' OG1' ' HB3' ' A' ' 55' ' ' CYS . 1.6 p -111.77 153.28 26.75 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 121.542 -0.724 . . . . 0.0 112.041 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.66 115.36 1.22 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.968 0.907 . . . . 0.0 112.372 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.435 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 61.7 mtm180 57.17 33.82 23.89 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 124.283 1.033 . . . . 0.0 112.672 176.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.401 ' HB3' ' OG1' ' A' ' 52' ' ' THR . 27.7 p -69.15 -23.21 63.93 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.491 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.511 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.5 p-10 -84.38 70.64 10.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 123.394 1.568 . . . . 0.0 110.0 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 59.5 pttt . . . . . 0 N--CA 1.418 -2.059 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.966 -176.401 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 CA--C 1.486 -1.51 0 CA-C-O 121.269 0.557 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.633 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 18.6 pttm -109.66 118.26 36.09 Favored 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 172.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.581 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 92.1 m -132.6 164.57 26.38 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.431 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 77.4 m-85 -82.66 86.74 6.79 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.46 -174.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.626 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 63.1 tt0 -84.62 -42.09 15.73 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.062 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.421 ' C ' ' H ' ' A' ' 8' ' ' LYS . 30.2 m170 -106.6 20.18 19.39 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.544 -178.129 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.05 14.91 Favored Glycine 0 CA--C 1.502 -0.734 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 -173.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.421 ' H ' ' C ' ' A' ' 6' ' ' HIS . 35.4 mtmm -105.2 155.84 18.67 Favored 'General case' 0 N--CA 1.416 -2.153 0 C-N-CA 125.055 1.342 . . . . 0.0 108.331 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.2 t -73.16 118.38 18.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 123.75 0.656 . . . . 0.0 111.049 -176.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.7 m -114.22 151.14 16.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.1 m -90.91 101.97 14.73 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.4 m -74.09 141.45 45.66 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.94 163.68 19.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 -173.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -55.58 -20.64 14.14 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -178.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.491 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.4 m-20 -72.3 -25.16 61.47 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.653 0.74 . . . . 0.0 109.551 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.427 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -87.53 101.02 13.21 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.638 -175.241 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -98.39 -12.73 21.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.646 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.31 122.14 27.38 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -175.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 63.2 m -87.51 128.14 35.24 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 173.066 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.419 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 43.4 p90 -110.33 157.9 19.01 Favored 'General case' 0 C--N 1.296 -1.742 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.681 -172.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 19.4 t-160 -134.29 101.9 5.17 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.626 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 21.3 t-20 -93.97 96.31 9.61 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -85.05 -15.72 43.08 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.608 -173.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.428 ' HA2' HD21 ' A' ' 46' ' ' ASN . . . 68.22 -146.37 45.92 Favored Glycine 0 N--CA 1.43 -1.729 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.946 178.432 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 67.0 mtt -83.48 147.8 53.69 Favored Pre-proline 0 C--N 1.291 -1.937 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 175.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.93 113.01 3.09 Favored 'Trans proline' 0 C--O 1.247 0.975 0 C-N-CA 122.268 1.979 . . . . 0.0 111.723 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.437 ' HB3' ' HB3' ' A' ' 30' ' ' LEU . 55.6 m-85 -104.18 144.07 32.08 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.111 176.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -86.59 129.43 34.87 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 69.52 -4.14 1.45 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 124.466 1.106 . . . . 0.0 112.178 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 27' ' ' PHE . 6.9 tt -120.72 124.27 44.74 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -100.72 105.27 16.6 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tt -82.17 106.56 14.16 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 35.7 mm -115.24 98.8 7.35 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 CA-C-O 122.154 0.978 . . . . 0.0 112.478 -171.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.626 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 92.3 mt -111.79 66.85 0.64 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 170.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.626 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 27.9 mt-30 -99.94 115.0 28.65 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.135 178.267 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.17 -151.81 5.5 Favored Glycine 0 C--N 1.29 -1.977 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.225 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.435 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 74.3 m -131.3 135.01 46.93 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 178.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 t -130.48 149.27 52.23 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -177.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 17.7 m -66.53 -50.3 63.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -117.31 155.33 29.71 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 37.9 t -79.52 138.86 37.66 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.091 0.472 . . . . 0.0 111.675 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.8 t -87.54 115.4 24.94 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 172.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -91.58 95.46 9.94 Favored 'General case' 0 C--N 1.285 -2.225 0 CA-C-O 122.085 0.945 . . . . 0.0 112.341 -173.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.437 HG23 ' H ' ' A' ' 47' ' ' ASN . 5.1 t -159.6 155.56 26.45 Favored 'General case' 0 N--CA 1.414 -2.235 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.03 -30.8 70.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.428 HD21 ' HA2' ' A' ' 24' ' ' GLY . 38.9 t-20 -60.62 -36.15 77.91 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.107 178.202 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.437 ' H ' HG23 ' A' ' 44' ' ' THR . 7.4 t30 -113.31 115.03 27.51 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-O 121.489 0.662 . . . . 0.0 111.712 -174.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -87.31 153.05 21.77 Favored 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.5 m -133.71 136.07 44.42 Favored 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.1 p -139.77 155.84 47.08 Favored 'General case' 0 C--N 1.285 -2.233 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -121.27 27.64 8.24 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -174.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.0 m -122.08 153.16 39.02 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.782 -0.574 . . . . 0.0 109.527 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.633 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 4.9 m-20 -63.04 129.13 39.01 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 63.87 27.57 14.5 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.483 1.113 . . . . 0.0 112.22 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 27.1 p -75.26 -23.77 57.51 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.7 p-10 -88.26 72.38 9.04 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 123.151 1.453 . . . . 0.0 110.201 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 51.5 pttt . . . . . 0 C--N 1.284 -2.28 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.198 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.472 HD22 ' SG ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.628 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -109.28 116.99 32.93 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 120.835 0.35 . . . . 0.0 110.962 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.472 ' SG ' HD22 ' A' ' 1' ' ' LEU . 87.1 m -140.97 165.77 26.62 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.656 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.616 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 66.3 m-85 -82.93 82.91 7.99 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.306 -174.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.426 ' HB3' HG21 ' A' ' 10' ' ' VAL . 17.6 tm0? -84.68 -41.84 15.89 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.689 0.757 . . . . 0.0 110.075 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -103.35 19.46 19.64 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 122.394 1.092 . . . . 0.0 108.267 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.39 -27.4 11.99 Favored Glycine 0 C--O 1.219 -0.819 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 12.7 mptt -105.16 162.53 13.31 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.364 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.0 t -69.72 106.92 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 O-C-N 123.816 0.697 . . . . 0.0 110.703 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.426 HG21 ' HB3' ' A' ' 5' ' ' GLN . 30.8 m -117.53 152.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.4 m -87.9 112.64 22.75 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.331 0.586 . . . . 0.0 110.112 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.5 153.39 31.38 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -70.89 166.63 20.73 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.189 0.449 . . . . 0.0 110.954 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -65.88 -10.58 39.66 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.424 ' O ' ' HA ' ' A' ' 39' ' ' SER . 13.7 m-20 -77.05 -31.61 56.32 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 176.149 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.0 101.48 5.26 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.928 -174.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -94.11 -22.62 18.37 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.667 -178.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -126.2 147.02 49.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.346 -175.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -108.08 144.92 34.78 Favored 'General case' 0 C--N 1.272 -2.764 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 172.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 54.5 p90 -128.93 149.56 50.74 Favored 'General case' 0 N--CA 1.422 -1.848 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.807 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -126.72 102.36 7.03 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 174.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.557 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.3 t30 -104.38 112.25 25.22 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.358 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.4 p -69.19 -26.68 64.95 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 124.272 0.982 . . . . 0.0 113.004 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.37 -160.43 41.97 Favored Glycine 0 N--CA 1.428 -1.884 0 N-CA-C 109.921 -1.271 . . . . 0.0 109.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 99.1 mmm -98.79 138.36 20.68 Favored Pre-proline 0 C--N 1.288 -2.081 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.37 117.89 4.89 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.903 2.402 . . . . 0.0 113.28 -176.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -131.65 143.69 50.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -71.79 125.53 27.4 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 72.62 -3.29 2.39 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.22 1.408 . . . . 0.0 112.736 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.61 94.37 4.44 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-O 121.153 0.501 . . . . 0.0 110.672 -178.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -93.59 107.75 19.57 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 tp -77.03 105.52 8.16 Favored 'General case' 0 N--CA 1.424 -1.726 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 33' ' ' ILE . 30.6 mm -86.85 97.52 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 121.791 0.805 . . . . 0.0 110.938 -176.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.557 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 75.6 mt -111.53 63.99 0.62 Allowed 'General case' 0 N--CA 1.415 -2.181 0 CA-C-O 122.388 1.089 . . . . 0.0 108.872 172.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.1 112.64 25.38 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 113.884 -1.507 . . . . 0.0 107.505 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.8 -163.36 10.21 Favored Glycine 0 C--N 1.282 -2.425 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.983 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.6 m -125.83 142.44 51.51 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.0 t -133.93 154.31 51.17 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-O 121.191 0.519 . . . . 0.0 110.261 -177.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 5.5 m -71.02 -45.45 63.91 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.833 178.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.2 t -119.35 -171.36 2.1 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.3 t -128.52 134.87 48.78 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -90.27 101.08 13.8 Favored 'General case' 0 N--CA 1.426 -1.645 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 170.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.23 114.67 12.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.654 0.74 . . . . 0.0 112.949 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.595 HG23 ' H ' ' A' ' 47' ' ' ASN . 2.3 t -164.93 169.59 16.29 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 114.385 -1.28 . . . . 0.0 107.937 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -86.76 -24.85 24.95 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -75.35 -47.81 25.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.595 ' H ' HG23 ' A' ' 44' ' ' THR . 6.8 t30 -98.16 98.93 10.15 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.795 176.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.493 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 62.4 mttp -86.1 119.63 26.6 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.776 -177.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 56.8 m -102.84 131.74 49.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 21.3 p -139.46 156.07 47.18 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 3.3 p -126.89 33.44 4.94 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 13.4 m -119.5 157.78 27.61 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.1 124.58 22.0 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.682 0.277 . . . . 0.0 111.449 -176.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.7 mtm180 63.21 26.44 15.2 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 124.413 1.085 . . . . 0.0 111.756 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.7 p -72.76 -22.13 60.9 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -175.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -87.6 32.39 0.72 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.956 0.884 . . . . 0.0 111.716 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.616 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 N--CA 1.432 -1.338 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.352 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.47 HD13 ' SG ' ' A' ' 19' ' ' CYS . 25.1 mt . . . . . 0 CA--C 1.49 -1.34 0 CA-C-O 120.848 0.356 . . . . 0.0 111.668 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.441 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 23.5 pttm -109.16 107.57 17.9 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 173.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.608 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 76.5 m -135.25 165.94 24.27 Favored 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 -173.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 90.0 m-85 -79.66 74.01 6.35 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.491 0.662 . . . . 0.0 109.563 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.493 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 55.2 tt0 -84.59 -39.47 18.68 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.332 -177.232 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -106.08 19.67 20.16 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.755 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.86 -34.41 4.93 Favored Glycine 0 C--N 1.312 -0.777 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 38.2 mtmm -105.28 162.97 12.96 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.436 -0.882 . . . . 0.0 109.993 175.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.6 t -68.15 111.29 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 O-C-N 124.145 0.903 . . . . 0.0 108.791 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.493 ' CG2' ' HB3' ' A' ' 5' ' ' GLN . 34.1 m -130.85 152.27 37.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.8 m -76.9 112.63 13.71 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 121.383 0.611 . . . . 0.0 109.733 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.4 m -80.36 151.06 29.63 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.17 -0.923 . . . . 0.0 108.816 178.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.426 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 4.0 t-80 -61.95 162.43 9.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 122.924 0.49 . . . . 0.0 110.458 -174.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -69.27 -16.03 63.49 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -77.36 -23.67 50.8 Favored 'General case' 0 CA--C 1.496 -1.125 0 CA-C-O 121.531 0.681 . . . . 0.0 109.343 176.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.426 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.9 OUTLIER -78.45 101.37 7.27 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.513 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -90.11 -23.03 21.5 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.573 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -130.96 146.6 52.41 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.991 -172.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.47 ' SG ' HD13 ' A' ' 1' ' ' LEU . 32.0 m -110.67 130.63 55.52 Favored 'General case' 0 C--N 1.28 -2.427 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 172.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.4 p90 -119.45 162.08 19.45 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.767 -1.173 . . . . 0.0 113.587 -173.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 56.4 t60 -128.12 105.9 8.69 Favored 'General case' 0 N--CA 1.416 -2.17 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 169.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 34' ' ' LEU . 16.4 t-20 -97.75 123.18 41.58 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -178.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.8 p -91.35 120.83 32.55 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 120.989 0.424 . . . . 0.0 111.834 -175.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.96 -174.86 36.43 Favored Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 174.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 73.9 mtm -72.69 148.16 89.79 Favored Pre-proline 0 C--N 1.308 -1.197 0 CA-C-N 117.87 0.835 . . . . 0.0 109.609 177.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.24 110.31 1.97 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.183 1.922 . . . . 0.0 112.222 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.06 139.01 46.78 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -92.4 146.18 23.89 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.7 m120 66.85 7.42 5.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.154 0.982 . . . . 0.0 110.993 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.0 tp -147.9 88.47 1.68 Allowed 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -89.34 82.84 6.43 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.939 0.876 . . . . 0.0 109.968 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 pp -76.65 106.05 8.07 Favored 'General case' 0 N--CA 1.419 -2.005 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.3 tp -99.06 127.51 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.966 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.57 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 22' ' ' ASN . 80.3 mt -116.35 84.84 2.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -128.22 115.44 18.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.501 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.427 ' HA2' ' HA ' ' A' ' 5' ' ' GLN . . . -144.33 -177.97 19.64 Favored Glycine 0 N--CA 1.411 -2.978 0 N-CA-C 109.851 -1.299 . . . . 0.0 109.851 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.473 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 88.8 m -113.21 136.23 52.95 Favored 'General case' 0 C--N 1.275 -2.649 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.7 t -131.86 155.57 47.6 Favored 'General case' 0 C--N 1.293 -1.855 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.896 -174.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -84.16 -46.66 11.66 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 m -107.02 158.8 16.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 176.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 39.7 t -150.72 149.0 29.24 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 120.685 0.279 . . . . 0.0 110.887 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -119.8 92.46 3.79 Favored 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 170.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.07 110.07 1.7 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.04 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -139.19 -172.11 3.26 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-N 114.92 -1.037 . . . . 0.0 108.335 -177.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.16 -34.28 56.42 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 174.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -65.92 -57.91 6.78 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.129 -1.396 . . . . 0.0 109.995 178.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -110.56 109.79 20.25 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.179 0.514 . . . . 0.0 110.26 -177.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -101.88 121.96 43.1 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.613 -178.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 85.4 m -114.04 145.27 41.82 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-O 120.959 0.409 . . . . 0.0 111.493 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.9 p -139.67 154.81 47.6 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.6 m -128.47 70.31 1.37 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.699 0.761 . . . . 0.0 109.999 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.454 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 9.3 m -148.87 154.78 39.95 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.441 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 8.1 m-20 -63.91 126.08 26.49 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 -177.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 61.27 26.4 16.24 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.461 1.104 . . . . 0.0 112.595 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.454 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 30.1 p -71.64 -28.47 63.79 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.896 -0.721 . . . . 0.0 111.725 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.608 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.0 p-10 -90.85 69.44 6.45 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 122.704 1.24 . . . . 0.0 111.08 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.464 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.4 ptmt . . . . . 0 C--N 1.293 -1.884 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.095 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.41 ' HA ' ' OD1' ' A' ' 53' ' ' ASP . 28.9 mt . . . . . 0 CA--C 1.486 -1.507 0 CA-C-O 120.944 0.402 . . . . 0.0 111.514 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -110.63 113.3 25.8 Favored 'General case' 0 N--CA 1.414 -2.262 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.856 169.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 m -124.84 163.82 21.36 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -174.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.632 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 88.7 m-85 -80.12 94.0 5.91 Favored 'General case' 0 C--O 1.195 -1.791 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.492 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 61.8 tt0 -84.68 -38.86 19.27 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.901 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -106.59 7.8 30.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.871 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.95 -17.6 58.49 Favored Glycine 0 C--N 1.311 -0.839 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 -170.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -104.77 154.79 19.56 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 43.9 t -75.42 124.86 34.21 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 O-C-N 123.785 0.678 . . . . 0.0 110.04 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.9 m -130.37 152.37 37.36 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.9 m -79.31 119.27 22.12 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.6 m -76.97 163.38 26.77 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.342 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.57 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 7.4 t-80 -71.5 165.26 24.23 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.239 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.442 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 3.1 mmp_? -60.9 -21.53 63.44 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.385 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.85 -15.52 41.6 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 120.751 0.31 . . . . 0.0 111.042 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.57 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -76.79 103.5 6.78 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.664 0.745 . . . . 0.0 112.91 -173.198 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.15 -22.62 23.97 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.153 -178.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -134.77 151.88 51.31 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.937 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.8 m -96.99 129.46 44.45 Favored 'General case' 0 C--N 1.283 -2.317 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 169.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.427 ' CD2' ' HB2' ' A' ' 38' ' ' SER . 42.8 p90 -108.52 147.71 31.33 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 118.908 -1.117 . . . . 0.0 110.387 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -131.2 102.18 5.88 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 175.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.546 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.3 t-20 -97.93 103.55 15.5 Favored 'General case' 0 C--N 1.29 -1.98 0 N-CA-C 106.382 -1.711 . . . . 0.0 106.382 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.0 p -77.99 170.18 17.03 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 114.394 -1.275 . . . . 0.0 112.271 -173.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -153.99 171.68 32.64 Favored Glycine 0 N--CA 1.418 -2.518 0 N-CA-C 108.969 -1.652 . . . . 0.0 108.969 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 89.8 mtp -84.3 149.18 54.7 Favored Pre-proline 0 C--N 1.297 -1.68 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.17 112.45 3.43 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 121.951 1.767 . . . . 0.0 111.304 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -114.95 146.39 41.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -45.36 107.59 0.1 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.466 0.707 . . . . 0.0 111.659 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 68.3 17.9 9.22 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.768 1.227 . . . . 0.0 112.181 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.9 tp -141.08 93.33 2.58 Favored 'General case' 0 N--CA 1.428 -1.568 0 CA-C-O 121.806 0.812 . . . . 0.0 111.909 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -96.66 109.8 22.36 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 103.374 -2.825 . . . . 0.0 103.374 170.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.34 106.38 6.84 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 121.65 0.738 . . . . 0.0 109.737 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.42 ' HA ' HD13 ' A' ' 33' ' ' ILE . 18.4 mm -108.84 106.28 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.801 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.188 -176.005 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.5 mt -123.89 65.98 1.04 Allowed 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.891 174.322 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 52.2 mt-30 -102.61 116.99 33.71 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.56 -164.94 11.05 Favored Glycine 0 C--N 1.286 -2.204 0 C-N-CA 118.802 -1.666 . . . . 0.0 112.76 -178.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 24.5 m -117.73 135.39 54.06 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 177.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.427 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 47.4 t -133.98 152.73 51.96 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.336 -177.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 t -83.99 -34.13 24.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 43.6 p -115.35 -174.89 2.59 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.1 t -135.98 130.06 33.05 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.116 0.484 . . . . 0.0 111.885 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.2 m -91.87 104.43 16.86 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 172.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.16 102.33 5.72 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.462 -176.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.2 p -144.79 176.79 9.18 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -92.28 -17.53 24.63 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.873 0.844 . . . . 0.0 110.271 175.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -77.01 -37.85 54.21 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.192 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -113.2 108.28 17.06 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.379 0.609 . . . . 0.0 110.62 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -88.96 153.36 21.09 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.585 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.8 p -146.21 124.07 11.98 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.6 p -139.46 155.6 47.47 Favored 'General case' 0 C--N 1.278 -2.534 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 68.4 m -107.16 28.26 8.23 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -174.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.8 m -108.69 147.48 31.86 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.41 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 15.5 m-20 -65.9 124.4 22.4 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.434 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 66.16 28.34 10.17 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.479 1.112 . . . . 0.0 112.691 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.478 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.2 p -89.25 -9.07 52.04 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.624 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -85.21 37.63 0.68 Allowed 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.677 -0.639 . . . . 0.0 111.373 -176.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.632 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.5 pttm . . . . . 0 C--N 1.307 -1.257 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.758 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.646 HD13 ' SG ' ' A' ' 19' ' ' CYS . 17.0 mt . . . . . 0 CA--C 1.479 -1.775 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -109.3 101.83 10.8 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.481 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 70.9 m -133.39 164.52 26.94 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.054 0.454 . . . . 0.0 111.516 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.8 m-85 -82.31 83.43 7.44 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.0 -176.122 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -84.82 -41.84 15.69 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 119.508 -0.877 . . . . 0.0 110.403 177.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -106.38 19.3 20.72 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.532 0.682 . . . . 0.0 110.644 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.97 -35.46 4.54 Favored Glycine 0 C--N 1.305 -1.155 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -97.95 162.86 13.03 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 31.9 t -72.1 113.74 9.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 O-C-N 123.985 0.803 . . . . 0.0 109.473 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.12 151.88 34.49 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 34.4 m -79.86 121.62 25.64 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.17 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.3 m -86.33 136.95 32.95 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -62.13 165.02 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.921 0.763 . . . . 0.0 111.798 -170.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -64.44 -11.7 36.02 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.412 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.7 m-20 -78.92 -22.07 46.37 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -96.05 102.93 14.79 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.317 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -94.92 -16.62 22.7 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.248 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -130.61 130.81 44.47 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.607 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.646 ' SG ' HD13 ' A' ' 1' ' ' LEU . 45.2 m -95.84 143.89 26.66 Favored 'General case' 0 C--N 1.283 -2.298 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 174.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.528 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 48.4 p90 -126.77 153.1 46.01 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.986 -177.576 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.409 ' CE1' HD11 ' A' ' 33' ' ' ILE . 6.4 t60 -136.15 114.48 11.64 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.809 176.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.423 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 54.9 t-20 -76.45 112.84 13.4 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 175.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.7 t -151.75 -168.25 3.02 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 145.75 -94.96 0.17 Allowed Glycine 0 N--CA 1.427 -1.951 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.0 mtm -97.44 153.87 38.21 Favored Pre-proline 0 C--N 1.276 -2.6 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -60.53 126.96 21.26 Favored 'Trans proline' 0 C--O 1.254 1.298 0 C-N-CA 121.668 1.578 . . . . 0.0 110.672 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -73.88 130.09 39.2 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.651 -177.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -129.57 119.55 23.82 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m120 70.95 17.26 6.32 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.385 1.074 . . . . 0.0 110.371 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 tp -140.26 80.78 1.78 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -85.71 66.57 9.71 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 122.164 0.983 . . . . 0.0 111.044 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.75 122.77 39.52 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.361 -1.291 . . . . 0.0 108.851 174.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.409 HD11 ' CE1' ' A' ' 21' ' ' HIS . 5.6 tp -119.21 105.95 18.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.287 0 CA-C-O 121.792 0.806 . . . . 0.0 108.992 178.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB2' ' CB ' ' A' ' 22' ' ' ASN . 6.2 mp -94.97 91.91 6.61 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.962 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -119.26 112.01 18.93 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 176.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.42 -160.51 8.64 Favored Glycine 0 C--N 1.29 -2.021 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.92 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.481 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 76.4 m -138.26 137.25 37.31 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.9 t -133.96 155.37 50.06 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.097 0.475 . . . . 0.0 111.435 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 21.5 m -70.76 -39.03 73.47 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.426 -0.807 . . . . 0.0 110.085 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -131.9 132.65 43.8 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 20' ' ' TYR . 11.2 t -134.3 148.39 50.76 Favored 'General case' 0 C--N 1.294 -1.805 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.201 -173.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.9 m -98.68 100.17 11.36 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.12 110.84 1.97 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.062 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -148.21 176.65 10.06 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 -177.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -78.8 -29.27 44.8 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -71.32 -53.1 15.37 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.779 -1.1 . . . . 0.0 109.543 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -114.38 101.39 9.11 Favored 'General case' 0 N--CA 1.415 -2.182 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 60.3 tttm -82.86 108.02 15.9 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.673 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 34.0 m -100.13 128.12 46.26 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 p -140.19 156.15 46.63 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.637 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -115.96 34.99 4.67 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -174.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.1 m -136.59 156.3 48.75 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.055 -1.028 . . . . 0.0 111.237 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -48.31 122.62 5.5 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 124.904 1.282 . . . . 0.0 112.073 177.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 56.66 31.29 18.98 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.946 1.298 . . . . 0.0 113.409 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 31.9 p -77.25 -20.29 55.39 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.233 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.447 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 31.7 p-10 -89.91 67.06 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 122.925 1.345 . . . . 0.0 111.392 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.485 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.6 pttm . . . . . 0 N--CA 1.423 -1.8 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.57 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.404 HD13 ' SG ' ' A' ' 19' ' ' CYS . 31.0 mt . . . . . 0 CA--C 1.488 -1.43 0 CA-C-O 121.176 0.512 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 22.7 pttm -109.55 113.59 26.51 Favored 'General case' 0 N--CA 1.415 -2.18 0 CA-C-N 115.436 -0.802 . . . . 0.0 108.965 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.583 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 92.7 m -136.17 165.49 25.62 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.723 -174.699 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.551 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.6 m-85 -79.72 86.85 5.27 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.226 -174.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -85.09 -41.55 15.63 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.652 0.739 . . . . 0.0 111.389 177.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -106.49 -0.31 24.11 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.723 0.773 . . . . 0.0 111.052 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 121.68 -37.45 2.92 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 108.74 -1.744 . . . . 0.0 108.74 -175.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 19.1 ptpt -94.96 161.97 13.93 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.433 HG12 ' HB2' ' A' ' 2' ' ' LYS . 16.5 t -75.85 122.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.202 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.6 m -130.41 151.57 36.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 98.0 m -72.11 118.86 15.51 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.75 158.61 22.78 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.694 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 12.5 t-80 -61.07 159.63 11.41 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.55 0.74 . . . . 0.0 111.977 -173.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -51.77 -32.37 30.74 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.282 1.433 . . . . 0.0 111.984 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 39' ' ' SER . 10.1 m-20 -86.34 -14.17 44.34 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.163 0.506 . . . . 0.0 110.815 -174.298 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.694 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.5 OUTLIER -83.1 100.41 10.5 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.093 -176.31 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -97.55 -14.85 20.8 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.029 -177.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -131.36 147.85 52.61 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.485 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 57.4 m -107.38 145.97 32.23 Favored 'General case' 0 C--N 1.267 -2.981 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 174.054 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.446 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 47.7 p90 -130.83 147.48 52.49 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.715 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -119.5 101.71 8.13 Favored 'General case' 0 C--N 1.273 -2.737 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 172.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.616 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 23.7 t-20 -105.67 135.03 47.83 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.0 t -141.53 175.78 9.41 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -176.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.48 -157.96 20.5 Favored Glycine 0 CA--C 1.498 -1.007 0 C-N-CA 120.121 -1.038 . . . . 0.0 111.996 -176.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.9 mtm -75.55 128.81 83.26 Favored Pre-proline 0 C--N 1.313 -1.021 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -67.31 104.89 0.95 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 121.926 1.751 . . . . 0.0 113.46 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -132.52 145.62 51.3 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 125.728 1.611 . . . . 0.0 106.993 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -55.2 116.9 3.06 Favored 'General case' 0 C--O 1.245 0.857 0 O-C-N 123.41 0.444 . . . . 0.0 110.826 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 81.33 -3.38 1.68 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.233 1.413 . . . . 0.0 113.592 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -87.93 84.72 6.96 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.8 pttt -106.38 87.61 2.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.476 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.7 tp -83.98 106.06 15.35 Favored 'General case' 0 N--CA 1.417 -2.11 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.8 mm -104.28 100.7 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.947 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.688 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 90.1 mt -120.7 63.8 0.85 Allowed 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.37 -1.287 . . . . 0.0 107.537 174.061 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -91.6 114.84 27.48 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.94 -160.96 8.94 Favored Glycine 0 C--N 1.291 -1.956 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.686 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.583 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 78.2 m -128.4 145.34 51.12 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 173.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -133.89 162.13 32.87 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 16.2 t -82.0 -22.67 36.41 Favored 'General case' 0 N--CA 1.417 -2.108 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.164 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.8 p -133.01 176.41 8.52 Favored 'General case' 0 N--CA 1.424 -1.739 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 10.8 t -112.53 115.54 28.8 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.466 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.5 m -77.89 97.08 5.16 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 172.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.65 86.92 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 124.555 1.142 . . . . 0.0 114.067 -172.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.471 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 30.5 p -147.99 163.59 36.4 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 176.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -90.44 -17.18 27.62 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.284 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -72.52 -44.23 62.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.815 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.488 ' HB2' HD22 ' A' ' 22' ' ' ASN . 7.8 t30 -98.97 95.55 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 174.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 66.7 mttm -80.87 110.61 16.57 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.3 -175.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.7 p -99.79 133.6 43.91 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 22.2 p -140.27 156.36 46.5 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.6 p -132.21 68.03 1.51 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 121.346 0.594 . . . . 0.0 111.583 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -149.02 156.71 42.65 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.437 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 12.2 m-20 -61.99 127.86 33.38 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.6 mtt180 61.71 26.12 15.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.885 0.874 . . . . 0.0 113.064 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 28.2 p -72.02 -28.79 63.6 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.528 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.2 p-10 -86.82 66.28 9.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.537 1.16 . . . . 0.0 111.403 -176.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.551 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 23.5 pttm . . . . . 0 C--N 1.296 -1.721 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.313 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 C--O 1.207 -1.147 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.4 ' HE3' ' OD1' ' A' ' 53' ' ' ASP . 48.9 pttt -109.27 119.64 40.11 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.547 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 93.2 m -140.93 164.59 29.86 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.53 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.604 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 86.6 m-85 -80.64 89.2 5.7 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.62 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.532 ' HG2' ' HA2' ' A' ' 36' ' ' GLY . 25.6 mt-30 -80.31 -43.1 21.81 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.021 -1.072 . . . . 0.0 112.164 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -106.95 14.47 26.46 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.756 0.789 . . . . 0.0 109.371 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.73 -9.67 70.89 Favored Glycine 0 N--CA 1.44 -1.066 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -173.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.604 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.1 mttm -105.84 152.4 23.29 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 176.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.5 t -76.65 106.45 6.58 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -119.19 152.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 120.654 0.264 . . . . 0.0 111.022 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.9 m -79.43 106.03 11.17 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-O 121.274 0.559 . . . . 0.0 110.773 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 m -86.34 133.96 33.76 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 173.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -70.26 174.56 5.45 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.129 0.268 . . . . 0.0 110.652 -173.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 57.9 mtm180 -75.75 -3.87 37.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.234 0.54 . . . . 0.0 111.719 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -76.03 -29.8 58.22 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -86.04 101.02 12.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.27 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -91.41 -17.31 25.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.723 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -135.14 130.37 35.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.151 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 60.0 m -94.32 145.18 24.93 Favored 'General case' 0 C--N 1.277 -2.574 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 172.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -127.86 155.98 43.29 Favored 'General case' 0 C--N 1.282 -2.34 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.999 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -138.44 102.32 4.59 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 177.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.497 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.0 t30 -107.72 95.83 5.97 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 177.478 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 t -88.5 136.6 32.91 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.372 -171.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.76 135.96 23.85 Favored Glycine 0 N--CA 1.428 -1.867 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.774 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -62.65 155.7 68.09 Favored Pre-proline 0 C--N 1.315 -0.922 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.01 107.65 0.33 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 122.942 2.428 . . . . 0.0 113.322 179.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -132.33 143.69 50.04 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 174.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -71.24 115.65 10.64 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.406 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 71.98 -3.61 2.18 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.17 1.388 . . . . 0.0 113.499 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 36.1 tp -118.26 120.58 38.1 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.224 -0.591 . . . . 0.0 110.359 -177.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.34 89.19 2.48 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.022 0.915 . . . . 0.0 109.202 174.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.523 ' H ' HD23 ' A' ' 32' ' ' LEU . 2.0 pt? -76.35 106.11 7.79 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.426 HD12 ' O ' ' A' ' 22' ' ' ASN . 6.4 tp -121.05 118.89 57.7 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.114 -171.067 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.497 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 83.0 mt -115.42 98.43 6.73 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 177.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 3.8 pt20 -130.91 104.36 7.09 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-O 121.26 0.553 . . . . 0.0 110.223 -179.473 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.532 ' HA2' ' HG2' ' A' ' 5' ' ' GLN . . . -145.17 -144.46 4.14 Favored Glycine 0 N--CA 1.419 -2.48 0 C-N-CA 119.932 -1.127 . . . . 0.0 112.253 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 83.0 m -132.01 133.39 44.39 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.1 t -131.0 163.74 26.91 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-O 121.337 0.589 . . . . 0.0 109.643 -178.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.0 t -82.29 -15.16 53.93 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.366 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.2 m -141.16 164.53 30.0 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.0 t -97.43 129.29 44.66 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -78.45 105.67 9.87 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -78.53 114.23 17.25 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.717 -177.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.444 HG23 ' H ' ' A' ' 47' ' ' ASN . 11.3 t -173.22 -174.61 1.06 Allowed 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.71 -42.55 13.28 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 118.46 0.573 . . . . 0.0 111.96 -175.14 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -79.5 -27.07 41.45 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -173.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.444 ' H ' HG23 ' A' ' 44' ' ' THR . 7.7 t30 -90.63 107.35 19.11 Favored 'General case' 0 CA--C 1.491 -1.314 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.361 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -91.43 145.04 24.96 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.3 p -132.39 136.2 46.64 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.47 0.653 . . . . 0.0 111.115 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.2 p -140.09 157.35 45.77 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.92 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 m -124.88 45.14 2.61 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.8 t -148.03 165.42 30.82 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.868 179.319 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.4 ' OD1' ' HE3' ' A' ' 2' ' ' LYS . 1.0 OUTLIER -52.4 121.25 6.64 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 114.705 -1.134 . . . . 0.0 113.149 -176.804 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 45.9 mtm180 60.58 22.24 12.02 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 124.902 1.281 . . . . 0.0 113.579 175.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.9 p -71.21 -25.71 62.63 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -175.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -87.97 29.17 0.95 Allowed 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.113 0.482 . . . . 0.0 111.609 -174.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.565 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 C--O 1.254 1.331 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.238 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 24.6 mt . . . . . 0 CA--C 1.486 -1.516 0 CA-C-O 120.861 0.362 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -109.66 115.27 29.56 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.199 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.513 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 94.2 m -139.78 165.17 28.0 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.948 0.404 . . . . 0.0 111.887 -174.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.527 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 88.9 m-85 -75.33 87.11 2.53 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.347 -176.294 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -84.97 -41.73 15.59 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.825 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -102.41 -4.48 25.42 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.232 1.015 . . . . 0.0 109.215 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.2 -23.86 7.14 Favored Glycine 0 N--CA 1.429 -1.8 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -175.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 65.3 pttt -102.05 161.2 13.86 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.32 117.34 23.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.7 m -123.48 152.43 28.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 178.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.8 m -77.89 111.8 14.1 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.59 152.61 28.48 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -74.96 166.66 23.31 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 110.659 -0.126 . . . . 0.0 110.659 -173.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -53.02 -27.71 20.79 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.965 1.306 . . . . 0.0 112.623 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.552 ' O ' ' HA ' ' A' ' 39' ' ' SER . 6.6 m-20 -69.4 -31.14 69.32 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.473 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.1 OUTLIER -86.93 101.01 13.0 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.364 -175.209 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -110.94 -3.61 15.53 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.488 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.89 124.41 24.95 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 67.1 m -93.6 140.68 29.34 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.055 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.5 p90 -121.57 147.94 45.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 121.412 0.625 . . . . 0.0 111.71 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.419 ' HB2' ' HB2' ' A' ' 56' ' ' ASN . 1.9 t60 -135.66 101.44 4.78 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.576 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 19.5 t-20 -83.54 125.91 32.26 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 175.077 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 53.3 p -71.69 -13.8 61.84 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 123.744 0.652 . . . . 0.0 111.803 -174.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.4 -173.36 54.14 Favored Glycine 0 N--CA 1.423 -2.214 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.754 179.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 92.4 mtp -133.87 108.03 11.71 Favored Pre-proline 0 C--N 1.292 -1.909 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.89 108.48 1.92 Allowed 'Trans proline' 0 C--O 1.249 1.06 0 C-N-CA 122.577 2.185 . . . . 0.0 114.679 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -131.82 143.93 50.55 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 174.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -52.46 120.81 6.01 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.413 0.446 . . . . 0.0 112.133 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.0 m120 70.32 10.08 7.17 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.268 1.427 . . . . 0.0 112.931 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -113.75 88.31 2.82 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 175.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -85.82 83.48 7.82 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.9 tp -83.35 105.36 14.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.414 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.459 HD13 ' HA ' ' A' ' 33' ' ' ILE . 5.1 mm -125.23 121.13 59.95 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.014 178.322 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.576 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 48.6 mt -127.51 78.0 1.79 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -102.17 109.11 20.72 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.83 -158.76 7.85 Favored Glycine 0 C--N 1.292 -1.91 0 C-N-CA 119.895 -1.145 . . . . 0.0 112.539 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.3 m -132.07 139.64 48.59 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 176.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 t -132.25 161.02 34.49 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 120.874 0.369 . . . . 0.0 110.09 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.552 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 23.0 t -76.2 -33.81 59.27 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.217 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 t -137.29 151.12 48.33 Favored 'General case' 0 N--CA 1.417 -2.096 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 9.6 t -70.45 119.86 15.24 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 177.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.9 m -80.88 87.87 5.9 Favored 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.87 100.67 0.06 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.02 -172.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.508 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 3.7 p -142.53 159.48 42.16 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.693 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -84.23 -27.5 27.92 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -88.18 -0.49 57.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.552 0.691 . . . . 0.0 110.613 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.508 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.1 t30 -125.0 130.26 51.99 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.272 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -96.14 126.86 41.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.8 p -120.44 129.21 53.79 Favored 'General case' 0 C--N 1.283 -2.321 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -140.23 156.13 46.62 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.638 -177.513 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.3 p -110.09 27.31 9.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.6 m -119.98 150.54 40.36 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.56 136.25 55.36 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.501 -0.479 . . . . 0.0 109.986 -175.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 63.88 15.86 9.43 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.494 1.117 . . . . 0.0 113.007 177.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.401 ' C ' ' H ' ' A' ' 57' ' ' LYS . 30.1 p -73.28 -12.57 60.89 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.961 0.41 . . . . 0.0 111.749 -177.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.419 ' HB2' ' HB2' ' A' ' 21' ' ' HIS . 28.9 p-10 -92.48 29.78 1.64 Allowed 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.819 1.295 . . . . 0.0 109.023 -174.415 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.439 ' HG2' ' CE2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.415 -2.204 0 C-N-CA 127.924 2.489 . . . . 0.0 109.332 -177.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.559 HD13 ' SG ' ' A' ' 19' ' ' CYS . 25.2 mt . . . . . 0 CA--C 1.489 -1.396 0 CA-C-O 121.454 0.645 . . . . 0.0 112.248 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -110.15 117.81 34.69 Favored 'General case' 0 N--CA 1.414 -2.263 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 171.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.545 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 95.5 m -138.51 164.51 29.23 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 120.777 0.322 . . . . 0.0 111.104 -176.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -80.88 75.0 7.84 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.388 0.613 . . . . 0.0 110.742 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -80.27 -40.67 26.46 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.256 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -106.28 20.03 19.6 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-O 121.476 0.655 . . . . 0.0 109.875 -177.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.6 -39.16 3.03 Favored Glycine 0 CA--C 1.498 -1.013 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -91.3 150.33 21.35 Favored 'General case' 0 C--O 1.258 1.514 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 173.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.0 p -75.22 112.59 12.94 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.211 0 CA-C-O 121.611 0.72 . . . . 0.0 111.108 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -119.29 153.0 21.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.114 -175.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.4 m -78.75 116.17 18.92 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.427 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.4 m -80.09 158.26 26.47 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t-80 -65.76 162.87 17.8 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.249 0.477 . . . . 0.0 110.802 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -63.77 -12.25 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -79.54 -21.39 45.23 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.627 0.727 . . . . 0.0 109.365 177.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.2 mtt -86.28 101.43 13.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.85 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -93.67 -18.5 22.08 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.84 -177.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -131.85 150.84 52.03 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.693 -176.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.559 ' SG ' HD13 ' A' ' 1' ' ' LEU . 58.2 m -112.75 138.13 50.03 Favored 'General case' 0 C--N 1.276 -2.626 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 172.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -116.34 148.0 41.02 Favored 'General case' 0 C--N 1.297 -1.689 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.446 -175.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -124.57 101.93 7.37 Favored 'General case' 0 N--CA 1.413 -2.275 0 CA-C-N 113.904 -1.498 . . . . 0.0 106.977 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 47' ' ' ASN . 47.3 t-20 -102.62 130.04 49.39 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 38.4 p -83.21 -11.37 57.91 Favored 'General case' 0 C--N 1.289 -2.041 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.45 -134.02 12.42 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.5 mmm -118.04 148.23 43.08 Favored Pre-proline 0 C--N 1.281 -2.396 0 N-CA-C 105.301 -2.111 . . . . 0.0 105.301 173.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -64.98 104.25 0.56 Allowed 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 120.94 1.093 . . . . 0.0 111.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -133.34 143.72 49.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.858 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 -99.29 149.8 22.76 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 66.1 t30 70.87 13.05 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.435 1.094 . . . . 0.0 110.451 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.5 tp -119.96 106.94 12.52 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.775 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -105.62 89.17 3.02 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.4 mt -122.04 130.02 52.92 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.431 HD13 ' HA ' ' A' ' 33' ' ' ILE . 7.7 mm -95.53 129.3 45.83 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 CA-C-O 121.455 0.645 . . . . 0.0 111.77 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.465 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 5.6 mp -120.17 68.91 0.85 Allowed 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.812 175.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.46 ' HB3' HD22 ' A' ' 56' ' ' ASN . 26.1 mt-30 -122.6 113.5 19.35 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.27 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.01 -159.28 8.01 Favored Glycine 0 C--N 1.285 -2.259 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 19' ' ' CYS . 85.8 m -125.92 148.88 49.1 Favored 'General case' 0 C--N 1.285 -2.201 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.3 t -133.6 148.59 51.59 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.199 0.523 . . . . 0.0 110.564 -174.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.0 t -81.43 -40.33 23.53 Favored 'General case' 0 N--CA 1.425 -1.705 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.148 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.1 p -139.98 96.78 3.12 Favored 'General case' 0 N--CA 1.426 -1.651 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 15.3 t -92.14 153.94 19.01 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.761 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.1 t -110.27 109.39 19.83 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.46 ' HG3' ' HB2' ' A' ' 49' ' ' CYS . 2.5 mp0 -70.38 108.95 4.48 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.782 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.2 p -127.12 -169.58 2.06 Favored 'General case' 0 C--N 1.288 -2.1 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -97.78 -15.6 20.23 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 174.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.91 -42.96 23.05 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.666 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 5.5 t30 -125.41 118.5 25.99 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.505 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -95.96 145.01 25.77 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.46 ' HB2' ' HG3' ' A' ' 43' ' ' GLU . 34.0 m -123.33 116.29 23.07 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.85 148.98 40.79 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.0 p -118.62 22.21 12.15 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.559 0.695 . . . . 0.0 111.279 -175.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.8 m -116.31 147.8 41.2 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -65.05 138.87 58.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.448 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 62.87 19.7 11.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.365 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.3 p -67.0 -35.59 80.28 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.545 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -87.22 56.05 3.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.803 1.287 . . . . 0.0 111.529 -176.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? . . . . . 0 C--N 1.301 -1.504 0 CA-C-N 114.232 -1.349 . . . . 0.0 110.417 -179.845 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 1' ' ' LEU . 19.4 mt . . . . . 0 CA--C 1.487 -1.457 0 CA-C-O 121.286 0.565 . . . . 0.0 112.134 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -110.8 123.26 49.74 Favored 'General case' 0 N--CA 1.416 -2.129 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 170.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 m -133.33 162.0 32.99 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -176.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.486 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.3 m-85 -81.36 85.34 6.45 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.419 HE21 HG21 ' A' ' 10' ' ' VAL . 8.0 tt0 -77.45 -43.16 33.34 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 120.952 0.406 . . . . 0.0 111.867 -177.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -107.76 18.39 21.41 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.318 1.056 . . . . 0.0 109.203 174.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.79 -16.85 59.08 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -105.17 140.74 37.88 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.423 HG21 ' HG2' ' A' ' 54' ' ' ARG . 5.6 p -74.96 115.02 15.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 CA-C-O 122.007 0.908 . . . . 0.0 111.744 -178.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.419 HG21 HE21 ' A' ' 5' ' ' GLN . 29.5 m -120.35 152.29 23.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.976 -178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.9 m -71.84 118.04 14.18 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.373 0.606 . . . . 0.0 109.564 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.3 m -79.31 157.13 27.77 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -68.17 161.41 27.1 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -64.55 -6.45 7.54 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -81.37 -31.39 33.36 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -72.02 101.96 2.85 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.806 -174.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -95.42 -17.08 21.82 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.904 -1.498 . . . . 0.0 109.88 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -135.02 148.0 49.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.4 m -98.06 137.99 36.04 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 170.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.522 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 52.5 p90 -116.34 142.84 46.32 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 118.474 -1.291 . . . . 0.0 111.767 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -115.34 122.57 46.28 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -112.81 126.21 55.19 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 29.6 p -92.88 79.99 4.66 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.696 0.76 . . . . 0.0 110.765 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 32' ' ' LEU . . . -71.74 131.67 19.0 Favored Glycine 0 N--CA 1.432 -1.603 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.734 -177.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -55.68 151.47 22.16 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 124.642 1.177 . . . . 0.0 111.66 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.2 110.67 3.05 Favored 'Trans proline' 0 C--O 1.253 1.265 0 C-N-CA 122.383 2.055 . . . . 0.0 112.209 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -114.67 144.01 44.11 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 175.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -62.19 110.31 1.58 Allowed 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.489 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.4 m120 72.73 19.28 4.01 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 125.019 1.328 . . . . 0.0 111.861 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.2 tt -144.6 93.56 2.43 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-O 121.939 0.876 . . . . 0.0 109.088 176.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -93.43 107.19 19.07 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.526 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 66.0 tp -76.84 106.12 8.31 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-O 121.938 0.875 . . . . 0.0 110.555 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' A' ' 33' ' ' ILE . 10.3 mm -124.36 112.99 34.56 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.929 173.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -86.65 -66.37 0.91 Allowed 'General case' 0 N--CA 1.425 -1.713 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.086 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.522 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 28.7 mt-30 40.84 90.39 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 O-C-N 124.684 1.24 . . . . 0.0 113.436 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.12 -154.94 6.27 Favored Glycine 0 C--N 1.288 -2.111 0 C-N-CA 119.274 -1.441 . . . . 0.0 111.744 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.5 m -116.57 137.94 51.79 Favored 'General case' 0 C--N 1.29 -2.006 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 t -134.35 154.69 51.2 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.104 0.478 . . . . 0.0 110.539 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -87.63 -12.8 44.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.355 0.598 . . . . 0.0 109.397 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.0 m -134.16 165.54 24.84 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.099 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 28.0 t -107.16 117.18 33.39 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 120.684 0.278 . . . . 0.0 110.945 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.424 ' HB3' ' ND2' ' A' ' 47' ' ' ASN . 46.4 t -82.44 117.16 22.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 173.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -94.55 57.81 2.28 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.847 1.308 . . . . 0.0 111.603 -175.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.2 p -108.29 172.28 6.93 Favored 'General case' 0 N--CA 1.413 -2.304 0 CA-C-N 114.181 -1.372 . . . . 0.0 107.929 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -87.88 -26.19 22.88 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.205 177.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -72.95 -39.62 66.05 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.424 ' ND2' ' HB3' ' A' ' 42' ' ' SER . 6.2 t30 -114.98 119.3 36.02 Favored 'General case' 0 N--CA 1.422 -1.836 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -107.47 149.27 28.13 Favored 'General case' 0 C--N 1.287 -2.124 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.8 p -122.53 145.37 48.39 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.5 p -140.49 149.19 42.2 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -122.4 71.55 1.02 Allowed 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 121.766 0.793 . . . . 0.0 109.932 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.503 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 6.9 m -149.33 151.49 34.23 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -67.42 131.95 46.68 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.423 ' HG2' HG21 ' A' ' 9' ' ' VAL . 49.9 mtm180 65.12 21.97 12.24 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.706 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 27.7 p -73.87 -25.83 60.25 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.9 p-10 -88.24 50.84 2.05 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.276 1.036 . . . . 0.0 111.274 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.486 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 50.6 pttt . . . . . 0 C--N 1.306 -1.308 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.644 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.411 HD13 ' SG ' ' A' ' 19' ' ' CYS . 28.3 mt . . . . . 0 CA--C 1.49 -1.332 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -109.72 108.92 19.47 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.304 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.513 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 79.4 m -134.01 164.96 26.14 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.07 -173.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -84.07 81.43 8.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.417 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 9.3 tt0 -79.59 -41.62 26.72 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 121.732 0.777 . . . . 0.0 110.697 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -106.92 20.12 19.48 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 121.706 0.765 . . . . 0.0 109.871 -177.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 -24.82 14.55 Favored Glycine 0 CA--C 1.499 -0.968 0 N-CA-C 110.041 -1.223 . . . . 0.0 110.041 -176.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -105.07 158.91 16.24 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.58 121.09 22.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 O-C-N 123.634 0.584 . . . . 0.0 110.178 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.9 m -130.76 151.65 36.26 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.7 m -83.44 115.97 22.3 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.4 m -74.12 154.71 39.03 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -77.57 170.42 16.61 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 118.42 0.555 . . . . 0.0 109.792 -176.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -62.73 -25.33 68.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.187 0.595 . . . . 0.0 111.126 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -69.16 -30.78 69.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.489 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -82.89 105.29 13.78 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.591 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -94.95 -14.92 24.0 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.85 -178.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -131.21 145.35 51.89 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.34 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.411 ' SG ' HD13 ' A' ' 1' ' ' LEU . 62.3 m -109.8 133.16 53.46 Favored 'General case' 0 C--N 1.272 -2.776 0 N-CA-C 104.871 -2.27 . . . . 0.0 104.871 171.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 51.4 p90 -116.06 146.36 42.26 Favored 'General case' 0 N--CA 1.42 -1.943 0 C-N-CA 118.702 -1.199 . . . . 0.0 112.551 -177.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 56' ' ' ASN . 21.9 t-160 -124.83 102.3 7.49 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.108 -1.405 . . . . 0.0 107.639 177.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.472 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 3.3 t-20 -88.5 118.54 28.22 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 174.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.7 p -82.6 -22.11 34.92 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 123.808 0.693 . . . . 0.0 110.655 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.47 -146.75 49.11 Favored Glycine 0 N--CA 1.429 -1.807 0 N-CA-C 109.099 -1.6 . . . . 0.0 109.099 -176.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 26.5 mmt -116.82 154.88 49.57 Favored Pre-proline 0 C--N 1.279 -2.461 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 174.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -63.08 112.03 1.57 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 121.524 1.483 . . . . 0.0 110.91 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 34.4 m-85 -116.13 140.24 49.5 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.407 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -62.51 107.49 0.95 Allowed 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.908 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.9 m120 59.75 24.53 13.46 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.522 1.129 . . . . 0.0 111.167 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.77 113.02 14.19 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 121.328 0.585 . . . . 0.0 109.852 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -97.71 98.55 9.96 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -80.8 106.69 13.0 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 33' ' ' ILE . 17.0 mm -117.32 118.26 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.915 0 CA-C-O 121.956 0.884 . . . . 0.0 113.312 -175.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.472 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 6.2 mp -123.05 77.53 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.291 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.417 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 27.2 mt-30 -99.27 116.22 30.94 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.023 -0.989 . . . . 0.0 108.689 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.533 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -144.8 -173.37 16.04 Favored Glycine 0 CA--C 1.479 -2.162 0 C-N-CA 119.65 -1.262 . . . . 0.0 111.803 -179.191 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.3 m -113.5 138.13 50.56 Favored 'General case' 0 C--N 1.287 -2.144 0 N-CA-C 106.329 -1.73 . . . . 0.0 106.329 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -132.5 153.24 51.11 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 t -83.91 -46.05 12.54 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -113.87 -177.03 3.03 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.3 t -140.47 129.57 23.53 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.4 m -91.3 100.28 13.11 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 167.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.93 117.55 7.76 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.751 0.786 . . . . 0.0 112.799 -171.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.5 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 1.4 p -149.63 170.21 19.2 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.127 177.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -97.77 -18.49 18.76 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.465 0.65 . . . . 0.0 109.634 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -83.5 -27.69 29.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.108 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.5 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -118.17 95.41 4.88 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.566 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 79.7 tttt -79.0 108.25 12.34 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.481 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 28.5 p -100.12 119.85 38.96 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.5 p -130.68 155.96 45.72 Favored 'General case' 0 C--N 1.275 -2.661 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -115.11 21.61 14.07 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -112.77 151.54 30.2 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -65.16 134.89 54.7 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 110.538 -0.171 . . . . 0.0 110.538 -176.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 58.77 23.25 10.98 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.485 1.116 . . . . 0.0 113.029 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.7 p -71.09 -19.5 62.45 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 121.183 0.516 . . . . 0.0 111.472 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.513 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.5 p-10 -90.23 69.41 7.13 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 122.544 1.164 . . . . 0.0 110.998 -178.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttp . . . . . 0 N--CA 1.428 -1.535 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.691 -179.3 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.43 HD13 ' SG ' ' A' ' 19' ' ' CYS . 18.5 mt . . . . . 0 CA--C 1.487 -1.462 0 CA-C-O 121.037 0.446 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -110.38 113.67 26.51 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 5.5 m -123.87 164.18 19.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -172.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.412 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 81.6 m-85 -84.87 84.02 7.85 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -71.7 -42.42 67.4 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.19 -1.004 . . . . 0.0 110.584 178.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -106.02 7.12 31.77 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.56 0.695 . . . . 0.0 109.704 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.38 -14.58 63.3 Favored Glycine 0 C--N 1.31 -0.876 0 N-CA-C 107.926 -2.07 . . . . 0.0 107.926 -170.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.2 mttm -104.96 150.75 24.65 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.3 t -73.23 122.2 25.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 123.744 0.653 . . . . 0.0 110.384 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.8 m -121.57 151.07 24.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -84.01 113.34 20.93 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.5 m -83.77 143.5 29.93 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -65.95 169.5 6.65 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.225 0.466 . . . . 0.0 110.759 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -63.81 -9.78 16.62 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 124.295 1.038 . . . . 0.0 113.09 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -82.73 -29.0 30.07 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.439 ' HA ' ' HA ' ' A' ' 39' ' ' SER . 1.3 mpt? -81.98 101.65 10.44 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.529 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.09 -6.61 31.34 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.566 -177.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -134.8 148.61 50.23 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.267 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.43 ' SG ' HD13 ' A' ' 1' ' ' LEU . 25.3 m -99.77 137.18 38.6 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 171.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -112.35 147.29 36.68 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 118.173 -1.411 . . . . 0.0 111.313 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.4 t-160 -126.7 101.57 6.68 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 114.515 -1.22 . . . . 0.0 107.823 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.554 HD22 ' HB2' ' A' ' 47' ' ' ASN . 25.2 t-20 -101.07 115.01 29.49 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 175.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.5 p -79.38 -27.86 41.9 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.094 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.38 -146.66 49.08 Favored Glycine 0 N--CA 1.427 -1.912 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.291 178.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 69.5 mtm -90.91 138.21 26.31 Favored Pre-proline 0 C--N 1.292 -1.892 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.9 123.96 9.31 Favored 'Trans proline' 0 C--O 1.252 1.185 0 C-N-CA 122.465 2.11 . . . . 0.0 110.851 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.457 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 61.1 m-85 -123.84 143.33 50.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.328 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -71.05 114.43 9.09 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.698 -176.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 67.1 t30 66.33 26.51 10.26 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.9 1.28 . . . . 0.0 110.07 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.457 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 3.1 tm? -130.87 129.08 41.84 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -102.29 94.89 5.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.493 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.7 tp -78.17 109.58 12.4 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.197 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.6 mm -113.55 101.65 12.77 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.646 0 CA-C-O 121.347 0.594 . . . . 0.0 111.671 -176.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.46 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 9.6 mp -109.64 61.48 0.6 Allowed 'General case' 0 C--N 1.306 -1.325 0 CA-C-O 122.269 1.033 . . . . 0.0 108.794 171.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -96.71 130.39 43.95 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.63 -160.41 8.76 Favored Glycine 0 C--N 1.278 -2.668 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.938 178.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 m -119.87 135.99 54.66 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.8 t -133.72 150.85 51.51 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.255 0.55 . . . . 0.0 110.82 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 16' ' ' MET . 13.1 t -77.17 -45.47 26.59 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.385 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.5 m -119.69 -175.79 3.03 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 43.2 t -125.46 138.69 54.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.003 0.43 . . . . 0.0 110.62 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.3 p -88.88 173.51 8.48 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 123.482 0.713 . . . . 0.0 110.652 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -91.92 17.73 8.83 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.112 0.482 . . . . 0.0 111.011 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.44 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 7.8 p -82.38 146.03 29.58 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.741 -175.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.08 -26.2 14.3 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -74.58 -27.16 60.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.554 ' HB2' HD22 ' A' ' 22' ' ' ASN . 8.9 t30 -115.81 96.75 5.75 Favored 'General case' 0 N--CA 1.416 -2.142 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 174.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -87.82 154.28 20.67 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.131 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 31.5 p -130.03 142.68 50.59 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 p -140.21 147.52 40.19 Favored 'General case' 0 C--N 1.278 -2.523 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 26.0 t -116.93 68.49 0.74 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.925 0.869 . . . . 0.0 110.968 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.0 m -148.78 144.99 27.37 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -69.54 130.59 42.87 Favored 'General case' 0 C--N 1.287 -2.129 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.499 -177.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.4 mtp-105 69.19 26.4 5.48 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.599 1.159 . . . . 0.0 111.524 -178.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 28.4 p -78.71 -26.37 44.83 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 178.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.431 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 32.3 p-10 -83.45 70.61 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.839 1.304 . . . . 0.0 110.044 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.428 -1.541 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.896 -172.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.428 HD13 ' SG ' ' A' ' 19' ' ' CYS . 19.5 mt . . . . . 0 CA--C 1.478 -1.807 0 CA-C-O 120.556 0.217 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 10.5 ptpp? -109.23 112.34 24.44 Favored 'General case' 0 N--CA 1.414 -2.238 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 174.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 74.0 m -136.26 165.06 26.64 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.197 -175.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.441 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 92.7 m-85 -82.02 63.0 6.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.415 0.626 . . . . 0.0 110.611 -176.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.515 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 8.2 tt0 -70.61 -31.99 69.17 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.927 -175.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -106.21 -7.36 17.9 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 122.155 0.979 . . . . 0.0 109.297 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.39 -18.07 30.61 Favored Glycine 0 C--N 1.305 -1.146 0 N-CA-C 108.099 -2.001 . . . . 0.0 108.099 -171.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 62.2 mttp -104.76 155.54 18.79 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.538 -1.331 . . . . 0.0 107.649 175.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.8 t -73.18 108.24 4.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.46 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 29.5 m -123.54 151.04 27.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 94.6 m -82.37 108.18 15.6 Favored 'General case' 0 N--CA 1.418 -2.073 0 CA-C-O 121.475 0.655 . . . . 0.0 109.524 176.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 58.3 m -76.7 136.94 39.11 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 176.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -57.21 162.35 2.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.568 0.747 . . . . 0.0 111.227 -172.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -62.33 -17.42 58.8 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -176.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 39' ' ' SER . 7.0 m-20 -71.01 -30.35 66.56 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.756 0.789 . . . . 0.0 109.117 176.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -79.03 101.41 7.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.451 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -91.92 -22.19 20.18 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.028 -178.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -127.42 137.31 52.69 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.479 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.428 ' SG ' HD13 ' A' ' 1' ' ' LEU . 60.2 m -103.49 127.82 50.81 Favored 'General case' 0 C--N 1.279 -2.468 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -109.57 159.73 16.84 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.767 -0.773 . . . . 0.0 111.948 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.417 ' NE2' ' HB ' ' A' ' 23' ' ' THR . 7.8 t-160 -129.99 101.46 5.85 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.859 177.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.558 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.0 t-20 -101.36 118.23 36.56 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.417 ' HB ' ' NE2' ' A' ' 21' ' ' HIS . 8.9 t -118.63 134.66 54.95 Favored 'General case' 0 C--N 1.287 -2.122 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.063 -177.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.37 171.88 48.33 Favored Glycine 0 N--CA 1.432 -1.578 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 176.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 64.4 mtt -75.9 147.04 80.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.83 106.08 0.6 Allowed 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 122.401 2.067 . . . . 0.0 112.892 -178.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.444 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 56.1 m-85 -121.97 144.34 48.94 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -58.18 121.64 11.21 Favored 'General case' 0 C--O 1.242 0.709 0 O-C-N 123.402 0.439 . . . . 0.0 110.578 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 69.05 7.68 6.38 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.682 1.193 . . . . 0.0 112.502 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 59.6 tp -126.95 102.88 7.19 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.103 0.477 . . . . 0.0 110.654 -178.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -110.64 98.98 8.02 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 tp -93.61 106.13 18.12 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.263 0.554 . . . . 0.0 109.58 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.431 HG23 ' HG3' ' A' ' 35' ' ' GLN . 15.4 mm -123.69 112.21 32.24 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.264 178.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.558 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.1 mt -119.83 70.55 0.86 Allowed 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 121.691 0.758 . . . . 0.0 109.203 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.431 ' HG3' HG23 ' A' ' 33' ' ' ILE . 26.2 mt-30 -86.06 118.73 25.71 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 173.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.515 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -139.53 -160.17 8.25 Favored Glycine 0 N--CA 1.425 -2.042 0 C-N-CA 120.002 -1.094 . . . . 0.0 112.506 -175.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 74.1 m -135.13 135.75 41.37 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 t -133.78 156.56 47.78 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 121.305 0.574 . . . . 0.0 110.836 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 18.2 m -76.59 -33.47 58.44 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.082 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.1 m -141.92 139.31 32.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.64 165.41 11.45 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.4 p -95.6 169.17 10.22 Favored 'General case' 0 N--CA 1.42 -1.94 0 C-N-CA 124.5 1.12 . . . . 0.0 110.566 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -93.34 27.93 2.4 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.612 0.72 . . . . 0.0 110.144 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.483 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.7 p -74.88 144.15 43.5 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.678 -178.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.39 -29.34 18.09 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -73.08 -44.34 60.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.102 176.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.483 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -93.15 99.17 11.8 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 176.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -89.29 151.61 22.01 Favored 'General case' 0 C--N 1.282 -2.327 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.5 -174.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.0 p -147.16 144.49 29.02 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.7 p -139.51 155.51 47.49 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 114.49 -1.232 . . . . 0.0 107.822 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -113.63 32.77 5.58 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.1 m -119.95 150.4 40.56 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -65.69 129.92 41.48 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.533 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 61.81 27.09 16.51 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.491 -1.232 . . . . 0.0 112.577 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 30.1 p -77.56 -25.14 49.8 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.446 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.538 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -83.59 73.8 10.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 122.947 1.356 . . . . 0.0 110.315 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.294 -1.832 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.271 -177.044 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.414 HD13 ' SG ' ' A' ' 19' ' ' CYS . 30.8 mt . . . . . 0 CA--C 1.488 -1.423 0 CA-C-O 121.203 0.525 . . . . 0.0 111.905 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HB2' ' CG1' ' A' ' 9' ' ' VAL . 20.3 pttp -110.77 113.95 26.93 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.203 172.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.49 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 85.0 m -135.82 164.02 28.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.274 0.559 . . . . 0.0 112.212 -174.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -81.39 85.02 6.51 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 122.129 -0.357 . . . . 0.0 111.324 -174.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 10.0 tt0 -81.4 -43.2 19.31 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.754 -1.178 . . . . 0.0 112.103 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -107.0 19.35 20.57 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.578 0.704 . . . . 0.0 111.259 -178.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.13 -38.05 3.46 Favored Glycine 0 CA--C 1.497 -1.049 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 -176.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -100.5 163.44 12.36 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.406 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 41.0 t -72.86 132.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 O-C-N 123.557 0.536 . . . . 0.0 111.244 -176.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.464 HG21 HE21 ' A' ' 5' ' ' GLN . 16.5 m -126.41 152.09 33.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 174.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.45 120.46 29.84 Favored 'General case' 0 C--N 1.283 -2.317 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.947 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.4 m -80.47 143.88 33.01 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -74.07 169.35 17.68 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.11 -7.59 42.73 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.8 -29.64 56.08 Favored 'General case' 0 CA--C 1.495 -1.141 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -77.91 126.52 30.97 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.326 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -108.18 -24.92 11.32 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.156 -175.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -133.73 143.63 48.6 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.204 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.414 ' SG ' HD13 ' A' ' 1' ' ' LEU . 61.6 m -102.56 119.9 39.62 Favored 'General case' 0 C--N 1.278 -2.51 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 170.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.9 p90 -99.59 149.53 23.17 Favored 'General case' 0 N--CA 1.42 -1.926 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.811 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 -125.73 101.82 7.04 Favored 'General case' 0 C--N 1.278 -2.523 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.855 178.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.452 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.3 t30 -110.3 106.91 16.47 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.2 t -100.37 170.89 8.11 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.69 -165.17 29.32 Favored Glycine 0 C--N 1.3 -1.446 0 C-N-CA 119.738 -1.22 . . . . 0.0 111.047 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 86.1 mtp -74.06 133.48 78.53 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.4 104.47 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.902 1.735 . . . . 0.0 112.975 -176.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -133.21 143.67 49.3 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 114.865 -1.062 . . . . 0.0 108.444 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.497 ' HA ' ' NE ' ' A' ' 28' ' ' ARG . 2.0 mmp_? -70.79 129.82 40.09 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 73.69 17.05 3.75 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.652 1.181 . . . . 0.0 111.201 -176.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.79 91.58 3.59 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -104.04 105.14 15.22 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 68.0 tp -104.54 106.69 17.28 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 mm -103.66 103.39 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.094 0 CA-C-O 121.809 0.814 . . . . 0.0 111.147 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 84.2 mt -123.58 63.53 1.03 Allowed 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 170.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.533 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 21.3 mt-30 -109.5 114.95 29.01 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.974 -1.467 . . . . 0.0 107.247 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.55 -170.72 13.97 Favored Glycine 0 C--N 1.286 -2.209 0 C-N-CA 119.314 -1.422 . . . . 0.0 112.174 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 20.8 m -111.44 132.14 54.69 Favored 'General case' 0 C--N 1.285 -2.219 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -133.85 154.32 51.11 Favored 'General case' 0 C--N 1.302 -1.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.755 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -86.69 -11.3 51.63 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.358 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.5 m -141.47 -169.05 2.79 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.7 t -148.7 151.55 35.11 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.7 t -114.03 110.48 20.11 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 170.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -70.81 97.33 1.37 Allowed 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 122.825 1.298 . . . . 0.0 111.273 -176.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.401 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 24.9 p -135.91 178.15 7.28 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.962 -176.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -94.95 -28.21 15.28 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.344 0.592 . . . . 0.0 109.752 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -88.3 -36.6 16.58 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.401 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.5 t30 -102.76 106.08 16.63 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -94.07 153.67 18.02 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.146 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.2 m -132.31 124.84 29.61 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.6 p -129.59 147.11 51.35 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -114.48 25.67 10.84 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.5 m -114.05 147.02 39.4 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -66.87 133.04 49.26 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.4 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 66.19 18.77 11.02 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 124.83 1.252 . . . . 0.0 112.693 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.5 p -65.35 -31.87 73.22 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.101 0.477 . . . . 0.0 111.685 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.522 HD22 ' HB3' ' A' ' 35' ' ' GLN . 36.9 p-10 -83.87 47.51 1.31 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.175 0.988 . . . . 0.0 111.107 -176.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt . . . . . 0 C--O 1.249 1.054 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.011 178.884 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.472 HD13 ' SG ' ' A' ' 19' ' ' CYS . 33.9 mt . . . . . 0 CA--C 1.472 -2.048 0 CA-C-O 120.712 0.291 . . . . 0.0 110.915 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.45 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 23.3 pttm -109.04 106.68 16.72 Favored 'General case' 0 N--CA 1.411 -2.409 0 CA-C-O 121.615 0.722 . . . . 0.0 109.121 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 85.3 m -131.07 166.14 21.71 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.83 -174.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -77.37 74.3 3.93 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.458 ' HA ' ' HA2' ' A' ' 36' ' ' GLY . 1.0 OUTLIER -85.85 -42.04 14.47 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.669 0.747 . . . . 0.0 109.337 178.324 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -100.42 20.46 14.83 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 122.329 1.061 . . . . 0.0 108.939 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.54 -35.66 3.79 Favored Glycine 0 CA--C 1.496 -1.141 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -176.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -104.46 163.13 12.67 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.9 t -68.09 114.37 4.87 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 123.893 0.746 . . . . 0.0 109.043 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 35.8 m -128.85 151.98 36.38 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.445 -177.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.7 m -76.3 106.27 7.82 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.0 m -79.49 144.62 33.82 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -63.68 167.77 5.51 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.331 0.652 . . . . 0.0 112.466 -170.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -55.53 -23.31 25.73 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 125.064 1.346 . . . . 0.0 112.595 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 39' ' ' SER . 15.7 m-20 -84.35 -26.62 28.31 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -175.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -74.32 101.67 4.12 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.25 -177.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.414 ' HG3' ' O ' ' A' ' 15' ' ' ASP . 47.1 mttp -94.42 -22.83 18.05 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.01 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -128.39 148.41 50.69 Favored 'General case' 0 N--CA 1.429 -1.525 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.369 -173.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.472 ' SG ' HD13 ' A' ' 1' ' ' LEU . 57.3 m -106.32 136.22 46.44 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 104.565 -2.383 . . . . 0.0 104.565 170.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 43.4 p90 -125.59 152.98 44.38 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.87 -174.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.7 t-160 -130.4 102.61 6.25 Favored 'General case' 0 N--CA 1.421 -1.904 0 CA-C-N 113.886 -1.506 . . . . 0.0 107.007 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.601 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 5.0 t30 -90.27 102.29 15.02 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.0 p -67.85 -43.34 79.71 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.228 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.34 -152.52 41.66 Favored Glycine 0 N--CA 1.424 -2.121 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -176.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.471 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.2 mpp? -85.13 142.36 38.31 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.66 114.92 3.29 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.098 1.866 . . . . 0.0 109.947 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.471 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 52.3 m-85 -117.47 140.66 49.31 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 121.567 0.698 . . . . 0.0 110.614 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -91.87 127.88 37.5 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.726 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 65.9 t30 68.75 22.39 7.39 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.357 1.063 . . . . 0.0 110.064 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.1 tp -143.52 135.07 26.25 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.63 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -110.06 99.5 8.58 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.097 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -81.1 106.12 12.85 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 176.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.447 HD13 ' HA ' ' A' ' 33' ' ' ILE . 23.0 mm -112.15 115.01 48.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 CA-C-O 121.637 0.732 . . . . 0.0 112.74 -174.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.601 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 81.8 mt -133.94 72.84 1.48 Allowed 'General case' 0 N--CA 1.423 -1.808 0 CA-C-N 113.72 -1.582 . . . . 0.0 107.436 172.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -112.89 110.0 19.8 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.935 -177.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.458 ' HA2' ' HA ' ' A' ' 5' ' ' GLN . . . -145.19 -154.34 6.12 Favored Glycine 0 C--N 1.295 -1.75 0 C-N-CA 119.707 -1.235 . . . . 0.0 112.582 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.1 m -126.96 136.16 51.88 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 175.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.421 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 41.2 t -122.34 144.25 49.13 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.557 0.694 . . . . 0.0 111.663 -173.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 15.9 m -86.14 -30.2 22.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.724 178.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.2 m -142.19 104.27 4.42 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.0 t -116.52 136.85 52.64 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.634 -167.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.4 m -96.45 105.55 17.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.63 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.417 ' HG2' ' HB2' ' A' ' 49' ' ' CYS . 34.3 mt-10 -66.46 104.95 1.35 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.598 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -137.8 175.05 9.94 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.86 -36.52 64.87 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -63.76 -59.91 3.97 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.073 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.457 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 8.0 t30 -106.45 105.01 14.84 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.271 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 39.2 ttpt -86.22 116.71 24.57 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.17 -178.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.417 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 20.7 m -104.75 132.55 50.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.2 p -139.92 155.6 47.09 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.4 p -126.62 72.71 1.35 Allowed 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.819 0.819 . . . . 0.0 111.73 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.479 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 4.6 m -149.35 151.29 33.87 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 175.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.45 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 11.3 m-20 -66.86 126.08 27.93 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -177.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 69.93 18.88 7.16 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.499 1.52 . . . . 0.0 112.689 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.479 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.5 p -70.4 -20.35 62.94 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -176.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 28.9 p-10 -89.52 33.77 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.553 0.692 . . . . 0.0 110.786 -177.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 C--N 1.314 -0.935 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.574 -179.266 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 1' ' ' LEU . 21.5 mt . . . . . 0 CA--C 1.497 -1.09 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 11' ' ' THR . 21.8 pttp -110.91 116.18 30.79 Favored 'General case' 0 C--N 1.278 -2.518 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 169.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.5 m -133.78 165.22 25.48 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-O 121.125 0.488 . . . . 0.0 111.567 -172.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.569 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.6 m-85 -83.65 86.57 7.1 Favored 'General case' 0 C--O 1.189 -2.087 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 -174.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -76.88 -41.48 43.6 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.033 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -105.85 12.17 31.05 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.555 -177.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.77 -10.53 72.0 Favored Glycine 0 CA--C 1.517 0.217 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -171.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.535 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.3 mttt -105.51 153.29 21.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 28.0 t -76.93 108.89 10.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 O-C-N 123.316 0.385 . . . . 0.0 110.152 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.4 m -123.85 151.26 28.59 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 25.8 m -82.75 129.25 34.95 Favored 'General case' 0 C--N 1.285 -2.218 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -178.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 60.4 m -74.05 158.08 34.93 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.611 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 20.9 t-80 -70.71 165.53 22.79 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 -176.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -68.59 3.73 1.71 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -176.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.71 -12.75 15.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.552 0.692 . . . . 0.0 109.332 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.611 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -86.9 117.2 25.48 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.703 -172.033 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -104.57 -21.54 13.41 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.344 -1.298 . . . . 0.0 109.907 -177.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -128.86 150.0 50.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.84 -177.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 64.9 m -109.26 136.87 48.01 Favored 'General case' 0 C--N 1.276 -2.611 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -120.54 152.82 37.57 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.051 -176.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -134.68 101.87 5.09 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.547 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 5.2 t30 -97.74 104.7 16.75 Favored 'General case' 0 CA--C 1.485 -1.532 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.3 p -66.14 -36.47 83.22 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 123.797 0.686 . . . . 0.0 112.131 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.63 -132.09 29.36 Favored Glycine 0 N--CA 1.427 -1.945 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.39 124.28 36.22 Favored Pre-proline 0 C--N 1.282 -2.334 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -79.07 120.02 4.46 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.545 2.164 . . . . 0.0 111.37 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.459 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 96.9 m-85 -117.16 142.96 46.36 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -66.88 125.68 26.68 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.972 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 68.13 21.97 8.47 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.815 1.246 . . . . 0.0 111.586 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.459 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 54.7 tp -141.25 103.04 4.35 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.339 0.59 . . . . 0.0 111.092 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -83.75 98.25 9.58 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 tt -77.17 106.4 8.86 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 177.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.411 HG23 ' HG3' ' A' ' 35' ' ' GLN . 26.1 mm -104.57 111.26 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.743 -172.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.547 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 62.0 mt -126.28 59.33 1.34 Allowed 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.192 -1.367 . . . . 0.0 108.057 172.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.411 ' HG3' HG23 ' A' ' 33' ' ' ILE . 53.9 mt-30 -93.5 125.38 38.08 Favored 'General case' 0 N--CA 1.421 -1.898 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 176.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.4 -163.61 10.49 Favored Glycine 0 C--N 1.27 -3.124 0 C-N-CA 119.204 -1.475 . . . . 0.0 112.961 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 60.9 m -131.49 134.94 46.66 Favored 'General case' 0 C--N 1.286 -2.185 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 t -134.01 162.45 32.04 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.317 0.58 . . . . 0.0 110.217 -176.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -90.82 -15.73 29.53 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 177.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.4 m -132.7 -171.26 2.62 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.359 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.8 t -121.66 165.52 15.63 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.9 p -80.39 165.1 22.56 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 123.73 0.812 . . . . 0.0 112.007 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -85.83 -20.84 28.54 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.934 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 t -99.47 156.5 17.0 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.843 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -89.47 -15.61 32.69 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 123.972 0.795 . . . . 0.0 109.465 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -58.19 -32.12 67.95 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 122.618 1.199 . . . . 0.0 109.019 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 6.4 t30 -105.58 113.95 27.82 Favored 'General case' 0 N--CA 1.409 -2.502 0 CA-C-N 113.508 -1.678 . . . . 0.0 107.788 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -89.08 142.27 27.78 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.1 p -124.7 135.71 53.27 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.1 p -139.92 156.65 46.57 Favored 'General case' 0 C--N 1.269 -2.906 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 p -117.72 29.12 8.02 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -173.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.0 m -129.14 154.43 46.73 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.059 0.457 . . . . 0.0 110.985 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -50.98 124.51 11.48 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.06 0.944 . . . . 0.0 112.363 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 58.29 27.43 15.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.579 1.151 . . . . 0.0 113.68 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.2 p -76.59 -25.12 53.6 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -87.31 33.67 0.69 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -171.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.569 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 14.4 ptmm? . . . . . 0 C--N 1.302 -1.471 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.457 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.433 HD13 ' SG ' ' A' ' 19' ' ' CYS . 27.7 mt . . . . . 0 CA--C 1.479 -1.769 0 CA-C-O 121.574 0.702 . . . . 0.0 111.773 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 47.4 pttt -109.75 108.56 18.96 Favored 'General case' 0 C--N 1.28 -2.449 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.843 174.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.544 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 71.9 m -133.23 165.12 25.54 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.788 -173.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.46 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 91.8 m-85 -81.98 74.19 8.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.237 0.541 . . . . 0.0 110.623 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 8.2 tt0 -85.04 -35.83 21.63 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-O 121.444 0.64 . . . . 0.0 112.103 -177.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -105.81 9.44 32.91 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 122.26 1.029 . . . . 0.0 108.336 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 103.39 -38.33 3.28 Favored Glycine 0 CA--C 1.498 -1.009 0 N-CA-C 108.252 -1.939 . . . . 0.0 108.252 -174.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -93.05 162.81 13.89 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 113.925 -1.137 . . . . 0.0 108.217 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.406 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 57.6 t -71.77 123.2 25.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 16.5 m -120.48 152.12 23.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.67 103.02 15.54 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.7 m -82.43 142.06 32.25 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -69.66 170.88 9.95 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.4 mtm180 -76.32 -4.16 40.64 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -69.26 -31.62 70.27 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 171.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -82.14 101.32 10.35 Favored 'General case' 0 N--CA 1.422 -1.839 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.853 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -102.37 -8.27 21.32 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.278 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -134.71 136.11 42.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.257 -178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.433 ' SG ' HD13 ' A' ' 1' ' ' LEU . 82.9 m -101.69 136.41 41.57 Favored 'General case' 0 C--N 1.28 -2.447 0 N-CA-C 105.25 -2.129 . . . . 0.0 105.25 170.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.411 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 51.3 p90 -120.72 147.35 45.41 Favored 'General case' 0 C--N 1.293 -1.852 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.335 -176.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.459 ' NE2' ' HB ' ' A' ' 23' ' ' THR . 12.8 t-160 -120.21 102.31 8.41 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.564 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 6.3 t30 -104.64 102.82 12.4 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.459 ' HB ' ' NE2' ' A' ' 21' ' ' HIS . 9.9 t -102.04 -162.96 0.97 Allowed 'General case' 0 C--N 1.273 -2.72 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.32 -102.68 0.27 Allowed Glycine 0 N--CA 1.416 -2.66 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.1 mtt -128.38 157.84 73.37 Favored Pre-proline 0 C--N 1.285 -2.228 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.65 105.46 1.1 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.4 1.4 . . . . 0.0 110.224 176.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -91.21 143.69 26.4 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.115 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.67 118.0 20.35 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.115 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 66.32 18.91 10.99 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.921 0.888 . . . . 0.0 111.735 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.0 tp -145.67 132.14 19.73 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -117.53 106.35 13.05 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 66.3 tp -80.96 106.22 12.79 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.467 HG23 ' HG3' ' A' ' 35' ' ' GLN . 25.1 mm -115.24 96.52 4.68 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.142 -177.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.564 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 84.2 mt -106.77 61.32 0.63 Allowed 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 173.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 23.5 mt-30 -97.93 120.13 37.77 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.533 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -145.84 -163.3 10.19 Favored Glycine 0 C--N 1.284 -2.325 0 C-N-CA 119.813 -1.184 . . . . 0.0 112.636 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.0 m -122.17 137.68 54.74 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 173.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -133.68 157.43 45.83 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 t -81.37 -43.25 19.27 Favored 'General case' 0 N--CA 1.416 -2.127 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.0 p -105.58 178.85 4.44 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.9 t -120.52 126.65 50.89 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.491 0.186 . . . . 0.0 110.906 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.1 m -82.0 85.33 6.74 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.31 99.97 0.77 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.639 1.209 . . . . 0.0 113.023 -173.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.403 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 9.4 p -148.82 175.74 10.99 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-N 113.012 -1.904 . . . . 0.0 107.006 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -89.86 -32.55 16.84 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.052 0.454 . . . . 0.0 110.968 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -79.31 -36.91 38.86 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.807 0.337 . . . . 0.0 111.4 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.403 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 7.1 t30 -94.31 99.58 11.78 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 174.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -89.99 114.53 26.39 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.516 -174.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 32.0 p -104.2 136.02 44.59 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.38 176.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.7 p -139.54 155.6 47.41 Favored 'General case' 0 C--N 1.282 -2.361 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.997 -179.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -112.3 25.83 11.15 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.409 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 1.7 m -116.36 148.53 40.53 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -66.02 126.05 27.38 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 120.734 0.302 . . . . 0.0 111.175 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 65.7 24.75 11.53 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 124.843 1.257 . . . . 0.0 112.396 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.409 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 26.1 p -70.92 -19.56 62.57 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.177 0.513 . . . . 0.0 111.863 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.544 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 36.4 p-10 -89.43 70.54 8.06 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 122.469 1.128 . . . . 0.0 110.522 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.46 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 22.0 pttp . . . . . 0 C--N 1.306 -1.32 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.971 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 34.7 mt . . . . . 0 CA--C 1.484 -1.564 0 CA-C-O 120.858 0.361 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -110.92 113.58 26.26 Favored 'General case' 0 N--CA 1.415 -2.186 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.6 m -128.5 164.22 23.26 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.447 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 89.9 m-85 -82.78 76.94 9.6 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 122.37 -0.206 . . . . 0.0 111.371 -177.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.546 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.6 tt0 -77.92 -42.37 33.37 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.509 0.671 . . . . 0.0 111.187 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -90.91 -2.26 57.75 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.06 -14.96 62.17 Favored Glycine 0 C--N 1.307 -1.079 0 N-CA-C 107.242 -2.343 . . . . 0.0 107.242 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.4 mttt -105.03 155.82 18.62 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.3 t -70.87 113.13 6.52 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.1 m -125.88 152.22 32.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 16.1 m -82.37 126.62 32.39 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-O 121.185 0.517 . . . . 0.0 110.227 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.9 m -82.74 153.63 25.19 Favored 'General case' 0 C--N 1.297 -1.707 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.426 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.8 t-80 -67.62 160.88 26.97 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -62.88 -12.55 25.72 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -176.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -81.89 -24.34 35.75 Favored 'General case' 0 CA--C 1.504 -0.818 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.426 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.3 OUTLIER -73.51 126.0 29.23 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.699 -172.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -113.19 -24.25 9.52 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.13 -175.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -130.43 148.56 52.26 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.074 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.9 m -96.26 142.52 28.32 Favored 'General case' 0 C--N 1.286 -2.153 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 169.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.442 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 45.5 p90 -123.17 154.53 38.57 Favored 'General case' 0 C--N 1.294 -1.811 0 C-N-CA 118.466 -1.293 . . . . 0.0 111.429 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -131.97 106.05 7.8 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 174.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.436 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 27.0 t-20 -97.08 133.29 41.94 Favored 'General case' 0 C--N 1.289 -2.058 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 175.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.65 -164.35 1.8 Allowed 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -163.97 -75.65 0.03 OUTLIER Glycine 0 CA--C 1.476 -2.378 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 178.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 88.0 mtp -137.55 157.56 73.55 Favored Pre-proline 0 C--N 1.274 -2.71 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 175.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.62 143.64 24.33 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.946 1.764 . . . . 0.0 109.536 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.418 ' CB ' ' HB3' ' A' ' 30' ' ' LEU . 83.6 m-85 -116.18 142.9 46.21 Favored 'General case' 0 C--N 1.281 -2.4 0 CA-C-O 121.303 0.573 . . . . 0.0 112.221 -178.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -65.98 104.64 1.16 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.204 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 71.31 19.43 5.34 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 124.564 1.145 . . . . 0.0 111.301 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.418 ' HB3' ' CB ' ' A' ' 27' ' ' PHE . 66.0 tp -126.89 105.16 8.44 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -81.83 92.44 6.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 tt -82.9 106.26 14.58 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 20.9 mm -124.01 96.78 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.614 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.91 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.436 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 10.1 mp -104.98 60.91 0.69 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 170.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.563 ' HB3' HD22 ' A' ' 56' ' ' ASN . 25.8 mt-30 -103.45 126.52 50.65 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.583 -1.189 . . . . 0.0 108.262 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.04 -158.14 7.52 Favored Glycine 0 C--N 1.265 -3.39 0 C-N-CA 119.713 -1.232 . . . . 0.0 111.227 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 27.0 m -128.32 134.52 48.91 Favored 'General case' 0 C--N 1.281 -2.383 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.0 t -133.6 157.26 46.18 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.299 0.571 . . . . 0.0 110.245 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -87.8 -15.77 35.97 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.015 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.8 t -141.35 174.15 10.81 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.7 t -113.95 148.95 36.0 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 t -92.0 161.44 14.79 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -90.93 -12.45 36.01 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.985 0.421 . . . . 0.0 110.91 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -79.37 144.02 34.55 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-O 121.013 0.435 . . . . 0.0 110.478 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -2.88 53.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.991 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -76.89 -17.44 58.94 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.686 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -120.93 104.66 9.99 Favored 'General case' 0 N--CA 1.428 -1.572 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 53.4 mtpt -84.64 125.44 32.48 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.381 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.1 m -110.85 134.62 52.38 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.5 p -139.99 144.08 36.81 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -113.89 49.25 1.0 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -138.55 147.19 42.79 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 106.136 -1.801 . . . . 0.0 106.136 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -66.95 136.37 55.24 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.058 -177.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 63.72 19.77 11.89 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.438 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.0 p -68.12 -26.99 66.07 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.971 0.415 . . . . 0.0 110.841 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.563 HD22 ' HB3' ' A' ' 35' ' ' GLN . 36.2 p-10 -82.81 55.14 2.93 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 122.934 1.349 . . . . 0.0 111.09 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt . . . . . 0 N--CA 1.43 -1.474 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.196 -179.508 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.555 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 35.9 mt . . . . . 0 CA--C 1.482 -1.665 0 CA-C-O 121.095 0.474 . . . . 0.0 111.635 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 22.9 pttm -109.93 112.51 24.57 Favored 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 172.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.555 ' SG ' ' HB3' ' A' ' 1' ' ' LEU . 3.6 m -129.63 163.99 24.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.025 0.44 . . . . 0.0 110.622 -170.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.521 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 93.1 m-85 -81.36 90.48 6.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -83.95 -42.78 15.91 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.189 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -106.48 14.69 26.86 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.587 0.708 . . . . 0.0 109.181 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.2 -16.41 61.36 Favored Glycine 0 C--N 1.31 -0.91 0 N-CA-C 108.634 -1.786 . . . . 0.0 108.634 -172.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 92.1 mttt -105.09 159.01 16.17 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 56.3 t -81.4 119.05 30.24 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 123.612 0.57 . . . . 0.0 110.366 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 18.2 m -118.74 151.66 20.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.1 m -85.06 110.7 19.13 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.194 0.521 . . . . 0.0 109.752 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.4 m -85.77 140.76 30.2 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.986 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -71.42 172.35 9.62 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.769 -171.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -66.9 -10.55 49.82 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.506 1.122 . . . . 0.0 112.576 -177.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.407 ' HB2' ' SD ' ' A' ' 16' ' ' MET . 2.9 m-20 -73.94 -31.3 62.99 Favored 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 174.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.407 ' SD ' ' HB2' ' A' ' 15' ' ' ASP . 0.9 OUTLIER -86.8 114.13 23.21 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.814 -175.285 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -102.45 -16.28 16.23 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.964 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -134.25 145.27 48.98 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.091 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.524 ' SG ' HD13 ' A' ' 1' ' ' LEU . 33.7 m -92.74 140.81 29.14 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 168.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.54 ' CD2' ' HB2' ' A' ' 38' ' ' SER . 47.8 p90 -127.08 145.26 50.8 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.222 -1.391 . . . . 0.0 111.959 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -120.99 101.14 7.48 Favored 'General case' 0 C--N 1.274 -2.695 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 172.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.583 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.4 t-20 -104.48 138.05 41.44 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.4 t -162.4 -172.49 3.19 Favored 'General case' 0 N--CA 1.402 -2.869 0 N-CA-C 106.056 -1.831 . . . . 0.0 106.056 -177.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -139.08 -142.83 4.33 Favored Glycine 0 CA--C 1.481 -2.078 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -178.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.2 mtt -87.39 156.7 53.75 Favored Pre-proline 0 C--N 1.289 -2.047 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.09 106.39 1.71 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 121.709 1.606 . . . . 0.0 111.372 176.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.446 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 47.8 m-85 -107.43 138.24 43.99 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.3 mtp180 -60.04 123.81 18.27 Favored 'General case' 0 C--N 1.319 -0.731 0 O-C-N 123.124 0.265 . . . . 0.0 110.839 -177.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 69.75 4.99 4.99 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.757 1.223 . . . . 0.0 113.365 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 63.8 tp -120.2 88.82 3.01 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-O 121.575 0.702 . . . . 0.0 109.976 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -87.55 87.63 7.45 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.629 HD23 ' H ' ' A' ' 32' ' ' LEU . 2.2 pt? -82.17 113.1 19.77 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 121.658 0.742 . . . . 0.0 110.385 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.7 mm -123.51 111.86 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.604 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.583 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 91.0 mt -124.64 67.98 1.09 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.002 175.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -94.1 112.7 24.54 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.496 177.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.95 -158.15 7.52 Favored Glycine 0 C--N 1.283 -2.382 0 C-N-CA 120.104 -1.046 . . . . 0.0 110.927 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.7 m -123.87 134.34 53.59 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 175.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.54 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 45.7 t -112.37 144.59 41.56 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.263 0.554 . . . . 0.0 111.173 -173.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.8 m -86.46 -35.08 19.87 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 114.986 -1.007 . . . . 0.0 108.381 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.9 p -149.73 122.05 8.42 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.485 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.9 t -79.72 148.36 31.56 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.1 m -89.3 116.01 27.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 173.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -66.55 99.27 0.57 Allowed 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 122.241 1.019 . . . . 0.0 112.717 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.658 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.1 p -141.94 179.34 6.93 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.072 -179.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -94.95 -52.23 4.33 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.358 -178.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -76.76 -25.83 53.88 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.249 -173.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.658 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t30 -81.61 105.21 12.58 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 57.8 mtpt -88.3 120.32 29.55 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.736 -174.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.2 m -121.8 126.26 48.39 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -139.9 155.43 47.19 Favored 'General case' 0 C--N 1.284 -2.264 0 C-N-CA 121.28 -0.168 . . . . 0.0 110.71 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -104.75 32.91 3.84 Favored 'General case' 0 CA--C 1.558 1.254 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -173.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.2 p -130.47 147.26 52.14 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 121.733 -0.604 . . . . 0.0 111.421 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.437 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 75.2 m-20 -57.13 133.94 55.45 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.185 -177.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 78.6 mtm180 64.14 16.19 9.84 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 125.049 1.34 . . . . 0.0 114.031 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 25.6 p -75.96 -14.28 60.24 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.172 -0.611 . . . . 0.0 112.249 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -87.34 30.62 0.78 Allowed 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.641 -0.662 . . . . 0.0 111.454 -176.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.517 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 13.5 ptmm? . . . . . 0 C--O 1.254 1.319 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.521 HD13 ' SG ' ' A' ' 19' ' ' CYS . 19.1 mt . . . . . 0 CA--C 1.486 -1.484 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 36.2 pttt -109.93 110.43 21.38 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.183 172.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.511 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 72.9 m -136.9 164.34 28.56 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.984 -175.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.435 ' CE2' ' HB3' ' A' ' 54' ' ' ARG . 82.7 m-85 -84.4 81.58 8.77 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -176.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.502 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.1 tt0 -84.74 -42.94 14.75 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.223 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -106.17 19.07 21.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 -177.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.48 -38.59 3.15 Favored Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.45 153.8 24.28 Favored 'General case' 0 N--CA 1.426 -1.639 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.2 t -69.73 111.58 3.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 13.0 m -111.31 152.04 13.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.7 m -89.12 117.38 28.07 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.4 m -74.35 156.38 37.15 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.117 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.681 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.9 t-80 -64.29 160.57 18.47 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.87 0.868 . . . . 0.0 110.695 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.44 ' HE ' ' HB2' ' A' ' 14' ' ' ARG . 17.6 mtm180 -53.17 -40.47 64.38 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.451 1.1 . . . . 0.0 109.522 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -79.86 -8.52 59.34 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.571 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.681 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.4 OUTLIER -92.37 101.38 13.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 121.717 0.77 . . . . 0.0 109.598 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -88.46 -19.49 26.42 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.17 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -135.05 155.46 50.71 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.521 ' SG ' HD13 ' A' ' 1' ' ' LEU . 86.3 m -113.47 145.78 40.63 Favored 'General case' 0 C--N 1.279 -2.486 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 171.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.1 p90 -124.61 150.59 45.81 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.421 -178.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 -127.24 111.94 14.53 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 177.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -102.27 105.85 16.56 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.515 ' O ' ' HA ' ' A' ' 46' ' ' ASN . 12.8 t -153.46 159.98 42.45 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.86 -51.73 0.7 Allowed Glycine 0 CA--C 1.467 -2.947 0 N-CA-C 108.099 -2.0 . . . . 0.0 108.099 -177.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 19.0 ptp -74.6 128.27 85.89 Favored Pre-proline 0 C--N 1.287 -2.149 0 CA-C-N 113.675 -1.262 . . . . 0.0 108.6 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -83.37 150.28 13.34 Favored 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 122.616 2.21 . . . . 0.0 111.783 -178.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -127.61 134.64 49.67 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.494 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -111.26 134.37 52.9 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.823 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.67 19.93 11.7 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.394 1.078 . . . . 0.0 111.562 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.7 tp -168.33 149.35 4.93 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 tptt -128.5 87.84 2.65 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 173.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -87.35 111.24 20.88 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.8 tp -122.67 99.29 6.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 CA-C-O 121.669 0.747 . . . . 0.0 109.625 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.1 mt -85.0 85.34 7.49 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.994 0.902 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.502 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 9.3 pt20 -116.59 107.73 15.08 Favored 'General case' 0 C--N 1.276 -2.602 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.393 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.22 -150.85 5.33 Favored Glycine 0 C--N 1.295 -1.7 0 C-N-CA 119.907 -1.14 . . . . 0.0 112.596 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.5 m -120.39 136.81 54.6 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.2 t -133.99 154.6 51.01 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 121.572 0.701 . . . . 0.0 111.229 -177.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.3 t -80.85 -20.99 41.12 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.491 177.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.1 p -127.64 170.21 12.92 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 120.763 0.316 . . . . 0.0 111.672 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 45.3 t -127.03 104.01 7.77 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 m -97.2 96.47 8.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -78.89 103.98 9.21 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.051 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.1 p -134.93 176.76 8.36 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -81.91 -28.82 32.64 Favored 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.0 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' A' ' 23' ' ' THR . 7.8 t30 -81.95 -47.24 12.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -103.11 106.45 16.97 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 94.6 mttt -101.57 120.17 39.9 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.919 -177.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 p -110.24 130.49 55.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.268 0.556 . . . . 0.0 111.49 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.0 p -139.42 156.5 46.93 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.062 0.945 . . . . 0.0 110.566 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.7 m -118.41 28.77 8.14 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.401 ' OG1' ' HB3' ' A' ' 55' ' ' CYS . 1.6 p -111.77 153.28 26.75 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 121.542 -0.724 . . . . 0.0 112.041 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.66 115.36 1.22 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.968 0.907 . . . . 0.0 112.372 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.435 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 61.7 mtm180 57.17 33.82 23.89 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 124.283 1.033 . . . . 0.0 112.672 176.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.401 ' HB3' ' OG1' ' A' ' 52' ' ' THR . 27.7 p -69.15 -23.21 63.93 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.491 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.511 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.5 p-10 -84.38 70.64 10.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 123.394 1.568 . . . . 0.0 110.0 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 59.5 pttt . . . . . 0 N--CA 1.418 -2.059 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.966 -176.401 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 CA--C 1.486 -1.51 0 CA-C-O 121.269 0.557 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.633 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 18.6 pttm -109.66 118.26 36.09 Favored 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 172.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.581 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 92.1 m -132.6 164.57 26.38 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.431 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 77.4 m-85 -82.66 86.74 6.79 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.46 -174.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.626 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 9.8 tt0 -84.62 -42.09 15.73 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.062 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.421 ' C ' ' H ' ' A' ' 8' ' ' LYS . 30.2 m170 -106.6 20.18 19.39 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.544 -178.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.05 14.91 Favored Glycine 0 CA--C 1.502 -0.734 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 -173.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.421 ' H ' ' C ' ' A' ' 6' ' ' HIS . 35.4 mtmm -105.2 155.84 18.67 Favored 'General case' 0 N--CA 1.416 -2.153 0 C-N-CA 125.055 1.342 . . . . 0.0 108.331 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.2 t -73.16 118.38 18.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 123.75 0.656 . . . . 0.0 111.049 -176.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.7 m -114.22 151.14 16.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.1 m -90.91 101.97 14.73 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.4 m -74.09 141.45 45.66 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.94 163.68 19.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 -173.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -55.58 -20.64 14.14 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -178.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.491 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.4 m-20 -72.3 -25.16 61.47 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.653 0.74 . . . . 0.0 109.551 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.427 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -87.53 101.02 13.21 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.638 -175.241 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -98.39 -12.73 21.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.646 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.31 122.14 27.38 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -175.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 63.2 m -87.51 128.14 35.24 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 173.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.419 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 43.4 p90 -110.33 157.9 19.01 Favored 'General case' 0 C--N 1.296 -1.742 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.681 -172.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 19.4 t-160 -134.29 101.9 5.17 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.626 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -93.97 96.31 9.61 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.352 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -85.05 -15.72 43.08 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.608 -173.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.428 ' HA2' HD21 ' A' ' 46' ' ' ASN . . . 68.22 -146.37 45.92 Favored Glycine 0 N--CA 1.43 -1.729 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.946 178.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 67.0 mtt -83.48 147.8 53.69 Favored Pre-proline 0 C--N 1.291 -1.937 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 175.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.93 113.01 3.09 Favored 'Trans proline' 0 C--O 1.247 0.975 0 C-N-CA 122.268 1.979 . . . . 0.0 111.723 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.437 ' HB3' ' HB3' ' A' ' 30' ' ' LEU . 55.6 m-85 -104.18 144.07 32.08 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.111 176.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -86.59 129.43 34.87 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 69.52 -4.14 1.45 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 124.466 1.106 . . . . 0.0 112.178 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 27' ' ' PHE . 6.9 tt -120.72 124.27 44.74 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -100.72 105.27 16.6 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tt -82.17 106.56 14.16 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 35.7 mm -115.24 98.8 7.35 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 CA-C-O 122.154 0.978 . . . . 0.0 112.478 -171.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.626 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 92.3 mt -111.79 66.85 0.64 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 170.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.626 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 27.9 mt-30 -99.94 115.0 28.65 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.135 178.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.17 -151.81 5.5 Favored Glycine 0 C--N 1.29 -1.977 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.225 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.435 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 74.3 m -131.3 135.01 46.93 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 178.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 t -130.48 149.27 52.23 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -177.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 17.7 m -66.53 -50.3 63.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -117.31 155.33 29.71 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 37.9 t -79.52 138.86 37.66 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.091 0.472 . . . . 0.0 111.675 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.8 t -87.54 115.4 24.94 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 172.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -91.58 95.46 9.94 Favored 'General case' 0 C--N 1.285 -2.225 0 CA-C-O 122.085 0.945 . . . . 0.0 112.341 -173.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.437 HG23 ' H ' ' A' ' 47' ' ' ASN . 5.1 t -159.6 155.56 26.45 Favored 'General case' 0 N--CA 1.414 -2.235 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.03 -30.8 70.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.428 HD21 ' HA2' ' A' ' 24' ' ' GLY . 38.9 t-20 -60.62 -36.15 77.91 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.107 178.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.437 ' H ' HG23 ' A' ' 44' ' ' THR . 7.4 t30 -113.31 115.03 27.51 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-O 121.489 0.662 . . . . 0.0 111.712 -174.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -87.31 153.05 21.77 Favored 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.5 m -133.71 136.07 44.42 Favored 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.1 p -139.77 155.84 47.08 Favored 'General case' 0 C--N 1.285 -2.233 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -121.27 27.64 8.24 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -174.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.0 m -122.08 153.16 39.02 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.782 -0.574 . . . . 0.0 109.527 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.633 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 4.9 m-20 -63.04 129.13 39.01 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 63.87 27.57 14.5 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.483 1.113 . . . . 0.0 112.22 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 27.1 p -75.26 -23.77 57.51 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.7 p-10 -88.26 72.38 9.04 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 123.151 1.453 . . . . 0.0 110.201 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 51.5 pttt . . . . . 0 C--N 1.284 -2.28 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.198 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.472 HD22 ' SG ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.628 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -109.28 116.99 32.93 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 120.835 0.35 . . . . 0.0 110.962 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.472 ' SG ' HD22 ' A' ' 1' ' ' LEU . 87.1 m -140.97 165.77 26.62 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.656 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.616 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 66.3 m-85 -82.93 82.91 7.99 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.306 -174.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.426 ' HB3' HG21 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -84.68 -41.84 15.89 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.689 0.757 . . . . 0.0 110.075 177.023 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -103.35 19.46 19.64 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 122.394 1.092 . . . . 0.0 108.267 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.39 -27.4 11.99 Favored Glycine 0 C--O 1.219 -0.819 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 12.7 mptt -105.16 162.53 13.31 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.0 t -69.72 106.92 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 O-C-N 123.816 0.697 . . . . 0.0 110.703 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.426 HG21 ' HB3' ' A' ' 5' ' ' GLN . 30.8 m -117.53 152.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.4 m -87.9 112.64 22.75 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.331 0.586 . . . . 0.0 110.112 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.5 153.39 31.38 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -70.89 166.63 20.73 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.189 0.449 . . . . 0.0 110.954 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -65.88 -10.58 39.66 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.424 ' O ' ' HA ' ' A' ' 39' ' ' SER . 13.7 m-20 -77.05 -31.61 56.32 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 176.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.0 101.48 5.26 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.928 -174.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -94.11 -22.62 18.37 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.667 -178.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -126.2 147.02 49.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.346 -175.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -108.08 144.92 34.78 Favored 'General case' 0 C--N 1.272 -2.764 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 172.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 54.5 p90 -128.93 149.56 50.74 Favored 'General case' 0 N--CA 1.422 -1.848 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.807 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 19.1 t-160 -126.72 102.36 7.03 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 174.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.557 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.3 t30 -104.38 112.25 25.22 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.4 p -69.19 -26.68 64.95 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 124.272 0.982 . . . . 0.0 113.004 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.37 -160.43 41.97 Favored Glycine 0 N--CA 1.428 -1.884 0 N-CA-C 109.921 -1.271 . . . . 0.0 109.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 99.1 mmm -98.79 138.36 20.68 Favored Pre-proline 0 C--N 1.288 -2.081 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.37 117.89 4.89 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.903 2.402 . . . . 0.0 113.28 -176.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -131.65 143.69 50.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -71.79 125.53 27.4 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 72.62 -3.29 2.39 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.22 1.408 . . . . 0.0 112.736 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.61 94.37 4.44 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-O 121.153 0.501 . . . . 0.0 110.672 -178.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -93.59 107.75 19.57 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 tp -77.03 105.52 8.16 Favored 'General case' 0 N--CA 1.424 -1.726 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 33' ' ' ILE . 30.6 mm -86.85 97.52 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 121.791 0.805 . . . . 0.0 110.938 -176.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.557 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 75.6 mt -111.53 63.99 0.62 Allowed 'General case' 0 N--CA 1.415 -2.181 0 CA-C-O 122.388 1.089 . . . . 0.0 108.872 172.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.1 112.64 25.38 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 113.884 -1.507 . . . . 0.0 107.505 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.8 -163.36 10.21 Favored Glycine 0 C--N 1.282 -2.425 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.983 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.6 m -125.83 142.44 51.51 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.0 t -133.93 154.31 51.17 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-O 121.191 0.519 . . . . 0.0 110.261 -177.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 5.5 m -71.02 -45.45 63.91 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.833 178.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.2 t -119.35 -171.36 2.1 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.3 t -128.52 134.87 48.78 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -90.27 101.08 13.8 Favored 'General case' 0 N--CA 1.426 -1.645 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 170.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.23 114.67 12.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.654 0.74 . . . . 0.0 112.949 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.595 HG23 ' H ' ' A' ' 47' ' ' ASN . 2.3 t -164.93 169.59 16.29 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 114.385 -1.28 . . . . 0.0 107.937 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -86.76 -24.85 24.95 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -75.35 -47.81 25.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.595 ' H ' HG23 ' A' ' 44' ' ' THR . 6.8 t30 -98.16 98.93 10.15 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.795 176.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.493 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 62.4 mttp -86.1 119.63 26.6 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.776 -177.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 56.8 m -102.84 131.74 49.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 21.3 p -139.46 156.07 47.18 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 3.3 p -126.89 33.44 4.94 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 13.4 m -119.5 157.78 27.61 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.1 124.58 22.0 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.682 0.277 . . . . 0.0 111.449 -176.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.7 mtm180 63.21 26.44 15.2 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 124.413 1.085 . . . . 0.0 111.756 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.7 p -72.76 -22.13 60.9 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -175.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -87.6 32.39 0.72 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.956 0.884 . . . . 0.0 111.716 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.616 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 N--CA 1.432 -1.338 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.352 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.47 HD13 ' SG ' ' A' ' 19' ' ' CYS . 25.1 mt . . . . . 0 CA--C 1.49 -1.34 0 CA-C-O 120.848 0.356 . . . . 0.0 111.668 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.441 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 23.5 pttm -109.16 107.57 17.9 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 173.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.608 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 76.5 m -135.25 165.94 24.27 Favored 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 -173.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 90.0 m-85 -79.66 74.01 6.35 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.491 0.662 . . . . 0.0 109.563 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.493 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 7.4 tt0 -84.59 -39.47 18.68 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.332 -177.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -106.08 19.67 20.16 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.755 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.86 -34.41 4.93 Favored Glycine 0 C--N 1.312 -0.777 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 38.2 mtmm -105.28 162.97 12.96 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.436 -0.882 . . . . 0.0 109.993 175.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.6 t -68.15 111.29 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 O-C-N 124.145 0.903 . . . . 0.0 108.791 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.493 ' CG2' ' HB3' ' A' ' 5' ' ' GLN . 34.1 m -130.85 152.27 37.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.8 m -76.9 112.63 13.71 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 121.383 0.611 . . . . 0.0 109.733 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.4 m -80.36 151.06 29.63 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.17 -0.923 . . . . 0.0 108.816 178.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.426 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 4.0 t-80 -61.95 162.43 9.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 122.924 0.49 . . . . 0.0 110.458 -174.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -69.27 -16.03 63.49 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -77.36 -23.67 50.8 Favored 'General case' 0 CA--C 1.496 -1.125 0 CA-C-O 121.531 0.681 . . . . 0.0 109.343 176.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.426 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.9 OUTLIER -78.45 101.37 7.27 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.513 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -90.11 -23.03 21.5 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.573 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -130.96 146.6 52.41 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.991 -172.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.47 ' SG ' HD13 ' A' ' 1' ' ' LEU . 32.0 m -110.67 130.63 55.52 Favored 'General case' 0 C--N 1.28 -2.427 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 172.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.4 p90 -119.45 162.08 19.45 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.767 -1.173 . . . . 0.0 113.587 -173.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -128.12 105.9 8.69 Favored 'General case' 0 N--CA 1.416 -2.17 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 169.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 34' ' ' LEU . 16.4 t-20 -97.75 123.18 41.58 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -178.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.8 p -91.35 120.83 32.55 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 120.989 0.424 . . . . 0.0 111.834 -175.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.96 -174.86 36.43 Favored Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 174.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 73.9 mtm -72.69 148.16 89.79 Favored Pre-proline 0 C--N 1.308 -1.197 0 CA-C-N 117.87 0.835 . . . . 0.0 109.609 177.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.24 110.31 1.97 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.183 1.922 . . . . 0.0 112.222 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.06 139.01 46.78 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -92.4 146.18 23.89 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.7 m120 66.85 7.42 5.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.154 0.982 . . . . 0.0 110.993 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.0 tp -147.9 88.47 1.68 Allowed 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -89.34 82.84 6.43 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.939 0.876 . . . . 0.0 109.968 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 pp -76.65 106.05 8.07 Favored 'General case' 0 N--CA 1.419 -2.005 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.3 tp -99.06 127.51 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.966 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.57 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 22' ' ' ASN . 80.3 mt -116.35 84.84 2.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -128.22 115.44 18.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.501 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.427 ' HA2' ' HA ' ' A' ' 5' ' ' GLN . . . -144.33 -177.97 19.64 Favored Glycine 0 N--CA 1.411 -2.978 0 N-CA-C 109.851 -1.299 . . . . 0.0 109.851 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.473 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 88.8 m -113.21 136.23 52.95 Favored 'General case' 0 C--N 1.275 -2.649 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.7 t -131.86 155.57 47.6 Favored 'General case' 0 C--N 1.293 -1.855 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.896 -174.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -84.16 -46.66 11.66 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 m -107.02 158.8 16.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 176.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 39.7 t -150.72 149.0 29.24 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 120.685 0.279 . . . . 0.0 110.887 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -119.8 92.46 3.79 Favored 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 170.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.07 110.07 1.7 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.04 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -139.19 -172.11 3.26 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-N 114.92 -1.037 . . . . 0.0 108.335 -177.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.16 -34.28 56.42 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 174.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -65.92 -57.91 6.78 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.129 -1.396 . . . . 0.0 109.995 178.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -110.56 109.79 20.25 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.179 0.514 . . . . 0.0 110.26 -177.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -101.88 121.96 43.1 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.613 -178.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 85.4 m -114.04 145.27 41.82 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-O 120.959 0.409 . . . . 0.0 111.493 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.9 p -139.67 154.81 47.6 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.6 m -128.47 70.31 1.37 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.699 0.761 . . . . 0.0 109.999 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.454 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 9.3 m -148.87 154.78 39.95 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.441 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 8.1 m-20 -63.91 126.08 26.49 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 -177.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 61.27 26.4 16.24 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.461 1.104 . . . . 0.0 112.595 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.454 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 30.1 p -71.64 -28.47 63.79 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.896 -0.721 . . . . 0.0 111.725 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.608 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.0 p-10 -90.85 69.44 6.45 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 122.704 1.24 . . . . 0.0 111.08 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.464 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.4 ptmt . . . . . 0 C--N 1.293 -1.884 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.095 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.41 ' HA ' ' OD1' ' A' ' 53' ' ' ASP . 28.9 mt . . . . . 0 CA--C 1.486 -1.507 0 CA-C-O 120.944 0.402 . . . . 0.0 111.514 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -110.63 113.3 25.8 Favored 'General case' 0 N--CA 1.414 -2.262 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.856 169.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 m -124.84 163.82 21.36 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -174.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.632 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 88.7 m-85 -80.12 94.0 5.91 Favored 'General case' 0 C--O 1.195 -1.791 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.492 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 9.2 tt0 -84.68 -38.86 19.27 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.901 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -106.59 7.8 30.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.871 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.95 -17.6 58.49 Favored Glycine 0 C--N 1.311 -0.839 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 -170.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -104.77 154.79 19.56 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 43.9 t -75.42 124.86 34.21 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 O-C-N 123.785 0.678 . . . . 0.0 110.04 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.9 m -130.37 152.37 37.36 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.9 m -79.31 119.27 22.12 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.6 m -76.97 163.38 26.77 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.342 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.57 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 7.4 t-80 -71.5 165.26 24.23 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.442 ' HA ' ' NE ' ' A' ' 14' ' ' ARG . 3.1 mmp_? -60.9 -21.53 63.44 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.385 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.85 -15.52 41.6 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 120.751 0.31 . . . . 0.0 111.042 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.57 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -76.79 103.5 6.78 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.664 0.745 . . . . 0.0 112.91 -173.198 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.15 -22.62 23.97 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.153 -178.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -134.77 151.88 51.31 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.937 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.8 m -96.99 129.46 44.45 Favored 'General case' 0 C--N 1.283 -2.317 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 169.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.427 ' CD2' ' HB2' ' A' ' 38' ' ' SER . 42.8 p90 -108.52 147.71 31.33 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 118.908 -1.117 . . . . 0.0 110.387 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.544 ' CD2' ' HG2' ' A' ' 35' ' ' GLN . 21.1 t-160 -131.2 102.18 5.88 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 175.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.546 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -97.93 103.55 15.5 Favored 'General case' 0 C--N 1.29 -1.98 0 N-CA-C 106.382 -1.711 . . . . 0.0 106.382 179.175 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.0 p -77.99 170.18 17.03 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 114.394 -1.275 . . . . 0.0 112.271 -173.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -153.99 171.68 32.64 Favored Glycine 0 N--CA 1.418 -2.518 0 N-CA-C 108.969 -1.652 . . . . 0.0 108.969 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 89.8 mtp -84.3 149.18 54.7 Favored Pre-proline 0 C--N 1.297 -1.68 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.17 112.45 3.43 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 121.951 1.767 . . . . 0.0 111.304 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -114.95 146.39 41.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -45.36 107.59 0.1 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.466 0.707 . . . . 0.0 111.659 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 68.3 17.9 9.22 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.768 1.227 . . . . 0.0 112.181 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.9 tp -141.08 93.33 2.58 Favored 'General case' 0 N--CA 1.428 -1.568 0 CA-C-O 121.806 0.812 . . . . 0.0 111.909 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -96.66 109.8 22.36 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 103.374 -2.825 . . . . 0.0 103.374 170.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.34 106.38 6.84 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 121.65 0.738 . . . . 0.0 109.737 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.42 ' HA ' HD13 ' A' ' 33' ' ' ILE . 18.4 mm -108.84 106.28 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.801 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.188 -176.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.5 mt -123.89 65.98 1.04 Allowed 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.891 174.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.544 ' HG2' ' CD2' ' A' ' 21' ' ' HIS . 52.2 mt-30 -102.61 116.99 33.71 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.56 -164.94 11.05 Favored Glycine 0 C--N 1.286 -2.204 0 C-N-CA 118.802 -1.666 . . . . 0.0 112.76 -178.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 24.5 m -117.73 135.39 54.06 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 177.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.427 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 47.4 t -133.98 152.73 51.96 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.336 -177.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 t -83.99 -34.13 24.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 43.6 p -115.35 -174.89 2.59 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.1 t -135.98 130.06 33.05 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.116 0.484 . . . . 0.0 111.885 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.2 m -91.87 104.43 16.86 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 172.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.16 102.33 5.72 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.462 -176.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.2 p -144.79 176.79 9.18 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -92.28 -17.53 24.63 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.873 0.844 . . . . 0.0 110.271 175.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -77.01 -37.85 54.21 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.192 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -113.2 108.28 17.06 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.379 0.609 . . . . 0.0 110.62 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -88.96 153.36 21.09 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.585 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.8 p -146.21 124.07 11.98 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.6 p -139.46 155.6 47.47 Favored 'General case' 0 C--N 1.278 -2.534 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 68.4 m -107.16 28.26 8.23 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -174.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.8 m -108.69 147.48 31.86 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.41 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 15.5 m-20 -65.9 124.4 22.4 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.434 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 66.16 28.34 10.17 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.479 1.112 . . . . 0.0 112.691 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.478 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.2 p -89.25 -9.07 52.04 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.624 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -85.21 37.63 0.68 Allowed 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.677 -0.639 . . . . 0.0 111.373 -176.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.632 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.5 pttm . . . . . 0 C--N 1.307 -1.257 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.758 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.646 HD13 ' SG ' ' A' ' 19' ' ' CYS . 17.0 mt . . . . . 0 CA--C 1.479 -1.775 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -109.3 101.83 10.8 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.481 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 70.9 m -133.39 164.52 26.94 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.054 0.454 . . . . 0.0 111.516 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.8 m-85 -82.31 83.43 7.44 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.0 -176.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -84.82 -41.84 15.69 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 119.508 -0.877 . . . . 0.0 110.403 177.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -106.38 19.3 20.72 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.532 0.682 . . . . 0.0 110.644 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.97 -35.46 4.54 Favored Glycine 0 C--N 1.305 -1.155 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -97.95 162.86 13.03 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 31.9 t -72.1 113.74 9.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 O-C-N 123.985 0.803 . . . . 0.0 109.473 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.12 151.88 34.49 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 34.4 m -79.86 121.62 25.64 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.17 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.3 m -86.33 136.95 32.95 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -62.13 165.02 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.921 0.763 . . . . 0.0 111.798 -170.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -64.44 -11.7 36.02 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.412 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.7 m-20 -78.92 -22.07 46.37 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -96.05 102.93 14.79 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.317 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -94.92 -16.62 22.7 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.248 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -130.61 130.81 44.47 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.607 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.646 ' SG ' HD13 ' A' ' 1' ' ' LEU . 45.2 m -95.84 143.89 26.66 Favored 'General case' 0 C--N 1.283 -2.298 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 174.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.528 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 48.4 p90 -126.77 153.1 46.01 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.986 -177.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -136.15 114.48 11.64 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.809 176.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.423 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 0.2 OUTLIER -76.45 112.84 13.4 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 175.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.7 t -151.75 -168.25 3.02 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 145.75 -94.96 0.17 Allowed Glycine 0 N--CA 1.427 -1.951 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.0 mtm -97.44 153.87 38.21 Favored Pre-proline 0 C--N 1.276 -2.6 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -60.53 126.96 21.26 Favored 'Trans proline' 0 C--O 1.254 1.298 0 C-N-CA 121.668 1.578 . . . . 0.0 110.672 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -73.88 130.09 39.2 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.651 -177.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -129.57 119.55 23.82 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m120 70.95 17.26 6.32 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.385 1.074 . . . . 0.0 110.371 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 tp -140.26 80.78 1.78 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -85.71 66.57 9.71 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 122.164 0.983 . . . . 0.0 111.044 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.75 122.77 39.52 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.361 -1.291 . . . . 0.0 108.851 174.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.6 tp -119.21 105.95 18.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.287 0 CA-C-O 121.792 0.806 . . . . 0.0 108.992 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB2' ' CB ' ' A' ' 22' ' ' ASN . 6.2 mp -94.97 91.91 6.61 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.962 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -119.26 112.01 18.93 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 176.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.42 -160.51 8.64 Favored Glycine 0 C--N 1.29 -2.021 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.92 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.481 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 76.4 m -138.26 137.25 37.31 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.9 t -133.96 155.37 50.06 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.097 0.475 . . . . 0.0 111.435 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 21.5 m -70.76 -39.03 73.47 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.426 -0.807 . . . . 0.0 110.085 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -131.9 132.65 43.8 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 20' ' ' TYR . 11.2 t -134.3 148.39 50.76 Favored 'General case' 0 C--N 1.294 -1.805 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.201 -173.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.9 m -98.68 100.17 11.36 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.12 110.84 1.97 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.062 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -148.21 176.65 10.06 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 -177.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -78.8 -29.27 44.8 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -71.32 -53.1 15.37 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.779 -1.1 . . . . 0.0 109.543 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -114.38 101.39 9.11 Favored 'General case' 0 N--CA 1.415 -2.182 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 60.3 tttm -82.86 108.02 15.9 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.673 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 34.0 m -100.13 128.12 46.26 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 p -140.19 156.15 46.63 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.637 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -115.96 34.99 4.67 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -174.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.1 m -136.59 156.3 48.75 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.055 -1.028 . . . . 0.0 111.237 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -48.31 122.62 5.5 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 124.904 1.282 . . . . 0.0 112.073 177.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 56.66 31.29 18.98 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.946 1.298 . . . . 0.0 113.409 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 31.9 p -77.25 -20.29 55.39 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.233 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.447 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 31.7 p-10 -89.91 67.06 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 122.925 1.345 . . . . 0.0 111.392 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.485 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.6 pttm . . . . . 0 N--CA 1.423 -1.8 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.57 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.404 HD13 ' SG ' ' A' ' 19' ' ' CYS . 31.0 mt . . . . . 0 CA--C 1.488 -1.43 0 CA-C-O 121.176 0.512 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 22.7 pttm -109.55 113.59 26.51 Favored 'General case' 0 N--CA 1.415 -2.18 0 CA-C-N 115.436 -0.802 . . . . 0.0 108.965 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.583 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 92.7 m -136.17 165.49 25.62 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.723 -174.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.551 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.6 m-85 -79.72 86.85 5.27 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.226 -174.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -85.09 -41.55 15.63 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.652 0.739 . . . . 0.0 111.389 177.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -106.49 -0.31 24.11 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.723 0.773 . . . . 0.0 111.052 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 121.68 -37.45 2.92 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 108.74 -1.744 . . . . 0.0 108.74 -175.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 19.1 ptpt -94.96 161.97 13.93 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.433 HG12 ' HB2' ' A' ' 2' ' ' LYS . 16.5 t -75.85 122.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.202 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.6 m -130.41 151.57 36.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 98.0 m -72.11 118.86 15.51 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.75 158.61 22.78 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.694 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 12.5 t-80 -61.07 159.63 11.41 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.55 0.74 . . . . 0.0 111.977 -173.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -51.77 -32.37 30.74 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.282 1.433 . . . . 0.0 111.984 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 39' ' ' SER . 10.1 m-20 -86.34 -14.17 44.34 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.163 0.506 . . . . 0.0 110.815 -174.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.694 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.5 OUTLIER -83.1 100.41 10.5 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.093 -176.31 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -97.55 -14.85 20.8 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.029 -177.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -131.36 147.85 52.61 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.485 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 57.4 m -107.38 145.97 32.23 Favored 'General case' 0 C--N 1.267 -2.981 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 174.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.446 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 47.7 p90 -130.83 147.48 52.49 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.715 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.2 t-160 -119.5 101.71 8.13 Favored 'General case' 0 C--N 1.273 -2.737 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 172.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.616 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 23.7 t-20 -105.67 135.03 47.83 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.0 t -141.53 175.78 9.41 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -176.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.48 -157.96 20.5 Favored Glycine 0 CA--C 1.498 -1.007 0 C-N-CA 120.121 -1.038 . . . . 0.0 111.996 -176.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.9 mtm -75.55 128.81 83.26 Favored Pre-proline 0 C--N 1.313 -1.021 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -67.31 104.89 0.95 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 121.926 1.751 . . . . 0.0 113.46 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -132.52 145.62 51.3 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 125.728 1.611 . . . . 0.0 106.993 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -55.2 116.9 3.06 Favored 'General case' 0 C--O 1.245 0.857 0 O-C-N 123.41 0.444 . . . . 0.0 110.826 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 81.33 -3.38 1.68 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.233 1.413 . . . . 0.0 113.592 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -87.93 84.72 6.96 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.8 pttt -106.38 87.61 2.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.476 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.7 tp -83.98 106.06 15.35 Favored 'General case' 0 N--CA 1.417 -2.11 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.8 mm -104.28 100.7 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.947 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.688 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 90.1 mt -120.7 63.8 0.85 Allowed 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.37 -1.287 . . . . 0.0 107.537 174.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -91.6 114.84 27.48 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.94 -160.96 8.94 Favored Glycine 0 C--N 1.291 -1.956 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.686 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.583 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 78.2 m -128.4 145.34 51.12 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 173.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -133.89 162.13 32.87 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 16.2 t -82.0 -22.67 36.41 Favored 'General case' 0 N--CA 1.417 -2.108 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.164 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.8 p -133.01 176.41 8.52 Favored 'General case' 0 N--CA 1.424 -1.739 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 10.8 t -112.53 115.54 28.8 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.466 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.5 m -77.89 97.08 5.16 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 172.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.65 86.92 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 124.555 1.142 . . . . 0.0 114.067 -172.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.471 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 30.5 p -147.99 163.59 36.4 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 176.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -90.44 -17.18 27.62 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.284 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -72.52 -44.23 62.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.815 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.488 ' HB2' HD22 ' A' ' 22' ' ' ASN . 7.8 t30 -98.97 95.55 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 174.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 66.7 mttm -80.87 110.61 16.57 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.3 -175.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.7 p -99.79 133.6 43.91 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 22.2 p -140.27 156.36 46.5 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.6 p -132.21 68.03 1.51 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 121.346 0.594 . . . . 0.0 111.583 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -149.02 156.71 42.65 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.437 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 12.2 m-20 -61.99 127.86 33.38 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.6 mtt180 61.71 26.12 15.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.885 0.874 . . . . 0.0 113.064 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 28.2 p -72.02 -28.79 63.6 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.528 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.2 p-10 -86.82 66.28 9.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.537 1.16 . . . . 0.0 111.403 -176.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.551 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 23.5 pttm . . . . . 0 C--N 1.296 -1.721 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.313 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 C--O 1.207 -1.147 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.4 ' HE3' ' OD1' ' A' ' 53' ' ' ASP . 48.9 pttt -109.27 119.64 40.11 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.547 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 93.2 m -140.93 164.59 29.86 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.53 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.604 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 86.6 m-85 -80.64 89.2 5.7 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.62 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.532 ' HG2' ' HA2' ' A' ' 36' ' ' GLY . 25.6 mt-30 -80.31 -43.1 21.81 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.021 -1.072 . . . . 0.0 112.164 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -106.95 14.47 26.46 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.756 0.789 . . . . 0.0 109.371 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.73 -9.67 70.89 Favored Glycine 0 N--CA 1.44 -1.066 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -173.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.604 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.1 mttm -105.84 152.4 23.29 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 176.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.5 t -76.65 106.45 6.58 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -119.19 152.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 120.654 0.264 . . . . 0.0 111.022 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.9 m -79.43 106.03 11.17 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-O 121.274 0.559 . . . . 0.0 110.773 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 m -86.34 133.96 33.76 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 173.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -70.26 174.56 5.45 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.129 0.268 . . . . 0.0 110.652 -173.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 57.9 mtm180 -75.75 -3.87 37.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.234 0.54 . . . . 0.0 111.719 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -76.03 -29.8 58.22 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -86.04 101.02 12.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.27 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -91.41 -17.31 25.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.723 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -135.14 130.37 35.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.151 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 60.0 m -94.32 145.18 24.93 Favored 'General case' 0 C--N 1.277 -2.574 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 172.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -127.86 155.98 43.29 Favored 'General case' 0 C--N 1.282 -2.34 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.999 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.406 ' CD2' HD11 ' A' ' 33' ' ' ILE . 12.9 t-80 -138.44 102.32 4.59 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 177.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.497 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 27.9 t-20 -107.72 95.83 5.97 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 177.478 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 t -88.5 136.6 32.91 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.372 -171.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.76 135.96 23.85 Favored Glycine 0 N--CA 1.428 -1.867 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.774 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -62.65 155.7 68.09 Favored Pre-proline 0 C--N 1.315 -0.922 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.01 107.65 0.33 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 122.942 2.428 . . . . 0.0 113.322 179.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -132.33 143.69 50.04 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 174.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -71.24 115.65 10.64 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.406 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 71.98 -3.61 2.18 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.17 1.388 . . . . 0.0 113.499 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 36.1 tp -118.26 120.58 38.1 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.224 -0.591 . . . . 0.0 110.359 -177.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.34 89.19 2.48 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.022 0.915 . . . . 0.0 109.202 174.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.523 HD23 ' H ' ' A' ' 32' ' ' LEU . 2.0 pt? -76.35 106.11 7.79 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.426 HD12 ' O ' ' A' ' 22' ' ' ASN . 6.4 tp -121.05 118.89 57.7 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.114 -171.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.497 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 83.0 mt -115.42 98.43 6.73 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 177.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 3.8 pt20 -130.91 104.36 7.09 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-O 121.26 0.553 . . . . 0.0 110.223 -179.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.532 ' HA2' ' HG2' ' A' ' 5' ' ' GLN . . . -145.17 -144.46 4.14 Favored Glycine 0 N--CA 1.419 -2.48 0 C-N-CA 119.932 -1.127 . . . . 0.0 112.253 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 83.0 m -132.01 133.39 44.39 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.1 t -131.0 163.74 26.91 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-O 121.337 0.589 . . . . 0.0 109.643 -178.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.0 t -82.29 -15.16 53.93 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.366 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.2 m -141.16 164.53 30.0 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.0 t -97.43 129.29 44.66 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -78.45 105.67 9.87 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -78.53 114.23 17.25 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.717 -177.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.444 HG23 ' H ' ' A' ' 47' ' ' ASN . 11.3 t -173.22 -174.61 1.06 Allowed 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.71 -42.55 13.28 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 118.46 0.573 . . . . 0.0 111.96 -175.14 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -79.5 -27.07 41.45 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -173.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.444 ' H ' HG23 ' A' ' 44' ' ' THR . 7.7 t30 -90.63 107.35 19.11 Favored 'General case' 0 CA--C 1.491 -1.314 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.361 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -91.43 145.04 24.96 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.3 p -132.39 136.2 46.64 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.47 0.653 . . . . 0.0 111.115 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.2 p -140.09 157.35 45.77 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.92 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 m -124.88 45.14 2.61 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.8 t -148.03 165.42 30.82 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.868 179.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.4 ' OD1' ' HE3' ' A' ' 2' ' ' LYS . 1.0 OUTLIER -52.4 121.25 6.64 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 114.705 -1.134 . . . . 0.0 113.149 -176.804 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 45.9 mtm180 60.58 22.24 12.02 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 124.902 1.281 . . . . 0.0 113.579 175.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.9 p -71.21 -25.71 62.63 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -175.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -87.97 29.17 0.95 Allowed 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.113 0.482 . . . . 0.0 111.609 -174.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.565 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 C--O 1.254 1.331 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.238 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 24.6 mt . . . . . 0 CA--C 1.486 -1.516 0 CA-C-O 120.861 0.362 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -109.66 115.27 29.56 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.199 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.513 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 94.2 m -139.78 165.17 28.0 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.948 0.404 . . . . 0.0 111.887 -174.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.527 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 88.9 m-85 -75.33 87.11 2.53 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.347 -176.294 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.471 HE21 HG21 ' A' ' 10' ' ' VAL . 8.5 tt0 -84.97 -41.73 15.59 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.825 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -102.41 -4.48 25.42 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.232 1.015 . . . . 0.0 109.215 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.2 -23.86 7.14 Favored Glycine 0 N--CA 1.429 -1.8 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -175.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 65.3 pttt -102.05 161.2 13.86 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.32 117.34 23.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.471 HG21 HE21 ' A' ' 5' ' ' GLN . 18.7 m -123.48 152.43 28.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 178.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.8 m -77.89 111.8 14.1 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.59 152.61 28.48 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -74.96 166.66 23.31 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 110.659 -0.126 . . . . 0.0 110.659 -173.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -53.02 -27.71 20.79 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.965 1.306 . . . . 0.0 112.623 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.552 ' O ' ' HA ' ' A' ' 39' ' ' SER . 6.6 m-20 -69.4 -31.14 69.32 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.473 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.1 OUTLIER -86.93 101.01 13.0 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.364 -175.209 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -110.94 -3.61 15.53 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.488 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.89 124.41 24.95 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 67.1 m -93.6 140.68 29.34 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.055 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.5 p90 -121.57 147.94 45.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 121.412 0.625 . . . . 0.0 111.71 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.419 ' HB2' ' HB2' ' A' ' 56' ' ' ASN . 20.2 t-160 -135.66 101.44 4.78 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.576 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 19.5 t-20 -83.54 125.91 32.26 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 175.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 53.3 p -71.69 -13.8 61.84 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 123.744 0.652 . . . . 0.0 111.803 -174.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.4 -173.36 54.14 Favored Glycine 0 N--CA 1.423 -2.214 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.754 179.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 92.4 mtp -133.87 108.03 11.71 Favored Pre-proline 0 C--N 1.292 -1.909 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.89 108.48 1.92 Allowed 'Trans proline' 0 C--O 1.249 1.06 0 C-N-CA 122.577 2.185 . . . . 0.0 114.679 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -131.82 143.93 50.55 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 174.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -52.46 120.81 6.01 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.413 0.446 . . . . 0.0 112.133 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.0 m120 70.32 10.08 7.17 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.268 1.427 . . . . 0.0 112.931 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -113.75 88.31 2.82 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 175.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -85.82 83.48 7.82 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.9 tp -83.35 105.36 14.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.414 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.459 HD13 ' HA ' ' A' ' 33' ' ' ILE . 5.1 mm -125.23 121.13 59.95 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.014 178.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.576 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 48.6 mt -127.51 78.0 1.79 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -102.17 109.11 20.72 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.83 -158.76 7.85 Favored Glycine 0 C--N 1.292 -1.91 0 C-N-CA 119.895 -1.145 . . . . 0.0 112.539 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.3 m -132.07 139.64 48.59 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 176.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 t -132.25 161.02 34.49 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 120.874 0.369 . . . . 0.0 110.09 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.552 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 23.0 t -76.2 -33.81 59.27 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 t -137.29 151.12 48.33 Favored 'General case' 0 N--CA 1.417 -2.096 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 9.6 t -70.45 119.86 15.24 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 177.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.9 m -80.88 87.87 5.9 Favored 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.87 100.67 0.06 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.02 -172.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.508 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 3.7 p -142.53 159.48 42.16 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.693 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -84.23 -27.5 27.92 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -88.18 -0.49 57.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.552 0.691 . . . . 0.0 110.613 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.508 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.1 t30 -125.0 130.26 51.99 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.272 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -96.14 126.86 41.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.8 p -120.44 129.21 53.79 Favored 'General case' 0 C--N 1.283 -2.321 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -140.23 156.13 46.62 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.638 -177.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.3 p -110.09 27.31 9.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.6 m -119.98 150.54 40.36 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.56 136.25 55.36 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.501 -0.479 . . . . 0.0 109.986 -175.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 63.88 15.86 9.43 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.494 1.117 . . . . 0.0 113.007 177.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.401 ' C ' ' H ' ' A' ' 57' ' ' LYS . 30.1 p -73.28 -12.57 60.89 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.961 0.41 . . . . 0.0 111.749 -177.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.419 ' HB2' ' HB2' ' A' ' 21' ' ' HIS . 28.9 p-10 -92.48 29.78 1.64 Allowed 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.819 1.295 . . . . 0.0 109.023 -174.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.439 ' HG2' ' CE2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.415 -2.204 0 C-N-CA 127.924 2.489 . . . . 0.0 109.332 -177.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.559 HD13 ' SG ' ' A' ' 19' ' ' CYS . 25.2 mt . . . . . 0 CA--C 1.489 -1.396 0 CA-C-O 121.454 0.645 . . . . 0.0 112.248 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -110.15 117.81 34.69 Favored 'General case' 0 N--CA 1.414 -2.263 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 171.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.545 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 95.5 m -138.51 164.51 29.23 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 120.777 0.322 . . . . 0.0 111.104 -176.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -80.88 75.0 7.84 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.388 0.613 . . . . 0.0 110.742 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -80.27 -40.67 26.46 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.256 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -106.28 20.03 19.6 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-O 121.476 0.655 . . . . 0.0 109.875 -177.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.6 -39.16 3.03 Favored Glycine 0 CA--C 1.498 -1.013 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -91.3 150.33 21.35 Favored 'General case' 0 C--O 1.258 1.514 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 173.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.0 p -75.22 112.59 12.94 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.211 0 CA-C-O 121.611 0.72 . . . . 0.0 111.108 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -119.29 153.0 21.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.114 -175.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.4 m -78.75 116.17 18.92 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.427 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.4 m -80.09 158.26 26.47 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t-80 -65.76 162.87 17.8 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.249 0.477 . . . . 0.0 110.802 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -63.77 -12.25 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -79.54 -21.39 45.23 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.627 0.727 . . . . 0.0 109.365 177.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.2 mtt -86.28 101.43 13.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.85 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -93.67 -18.5 22.08 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.84 -177.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -131.85 150.84 52.03 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.693 -176.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.559 ' SG ' HD13 ' A' ' 1' ' ' LEU . 58.2 m -112.75 138.13 50.03 Favored 'General case' 0 C--N 1.276 -2.626 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 172.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -116.34 148.0 41.02 Favored 'General case' 0 C--N 1.297 -1.689 0 C-N-CA 118.895 -1.122 . . . . 0.0 112.446 -175.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -124.57 101.93 7.37 Favored 'General case' 0 N--CA 1.413 -2.275 0 CA-C-N 113.904 -1.498 . . . . 0.0 106.977 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 47' ' ' ASN . 47.3 t-20 -102.62 130.04 49.39 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.27 -1.381 . . . . 0.0 107.27 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 38.4 p -83.21 -11.37 57.91 Favored 'General case' 0 C--N 1.289 -2.041 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.45 -134.02 12.42 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 109.878 -1.289 . . . . 0.0 109.878 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.5 mmm -118.04 148.23 43.08 Favored Pre-proline 0 C--N 1.281 -2.396 0 N-CA-C 105.301 -2.111 . . . . 0.0 105.301 173.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -64.98 104.25 0.56 Allowed 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 120.94 1.093 . . . . 0.0 111.184 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -133.34 143.72 49.16 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.858 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 -99.29 149.8 22.76 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 66.1 t30 70.87 13.05 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.435 1.094 . . . . 0.0 110.451 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.5 tp -119.96 106.94 12.52 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.775 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -105.62 89.17 3.02 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.4 mt -122.04 130.02 52.92 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.431 HD13 ' HA ' ' A' ' 33' ' ' ILE . 7.7 mm -95.53 129.3 45.83 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 CA-C-O 121.455 0.645 . . . . 0.0 111.77 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.465 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 5.6 mp -120.17 68.91 0.85 Allowed 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.812 175.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.46 ' HB3' HD22 ' A' ' 56' ' ' ASN . 26.1 mt-30 -122.6 113.5 19.35 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.27 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.01 -159.28 8.01 Favored Glycine 0 C--N 1.285 -2.259 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 19' ' ' CYS . 85.8 m -125.92 148.88 49.1 Favored 'General case' 0 C--N 1.285 -2.201 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 177.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.3 t -133.6 148.59 51.59 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.199 0.523 . . . . 0.0 110.564 -174.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.0 t -81.43 -40.33 23.53 Favored 'General case' 0 N--CA 1.425 -1.705 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.148 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.1 p -139.98 96.78 3.12 Favored 'General case' 0 N--CA 1.426 -1.651 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 15.3 t -92.14 153.94 19.01 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.761 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.1 t -110.27 109.39 19.83 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.46 ' HG3' ' HB2' ' A' ' 49' ' ' CYS . 2.5 mp0 -70.38 108.95 4.48 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.782 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.2 p -127.12 -169.58 2.06 Favored 'General case' 0 C--N 1.288 -2.1 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -97.78 -15.6 20.23 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 174.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.91 -42.96 23.05 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.666 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 5.5 t30 -125.41 118.5 25.99 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.505 178.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -95.96 145.01 25.77 Favored 'General case' 0 C--N 1.287 -2.112 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.46 ' HB2' ' HG3' ' A' ' 43' ' ' GLU . 34.0 m -123.33 116.29 23.07 Favored 'General case' 0 C--N 1.282 -2.362 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.2 p -116.85 148.98 40.79 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.0 p -118.62 22.21 12.15 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.559 0.695 . . . . 0.0 111.279 -175.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.8 m -116.31 147.8 41.2 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -65.05 138.87 58.61 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.448 -175.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 62.87 19.7 11.7 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.365 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.3 p -67.0 -35.59 80.28 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.545 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -87.22 56.05 3.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.803 1.287 . . . . 0.0 111.529 -176.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? . . . . . 0 C--N 1.301 -1.504 0 CA-C-N 114.232 -1.349 . . . . 0.0 110.417 -179.845 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 1' ' ' LEU . 19.4 mt . . . . . 0 CA--C 1.487 -1.457 0 CA-C-O 121.286 0.565 . . . . 0.0 112.134 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -110.8 123.26 49.74 Favored 'General case' 0 N--CA 1.416 -2.129 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 170.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 m -133.33 162.0 32.99 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -176.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.486 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.3 m-85 -81.36 85.34 6.45 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.419 HE21 HG21 ' A' ' 10' ' ' VAL . 8.0 tt0 -77.45 -43.16 33.34 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 120.952 0.406 . . . . 0.0 111.867 -177.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -107.76 18.39 21.41 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 122.318 1.056 . . . . 0.0 109.203 174.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.79 -16.85 59.08 Favored Glycine 0 C--N 1.307 -1.044 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -105.17 140.74 37.88 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.423 HG21 ' HG2' ' A' ' 54' ' ' ARG . 5.6 p -74.96 115.02 15.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 CA-C-O 122.007 0.908 . . . . 0.0 111.744 -178.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.419 HG21 HE21 ' A' ' 5' ' ' GLN . 29.5 m -120.35 152.29 23.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.976 -178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.9 m -71.84 118.04 14.18 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.373 0.606 . . . . 0.0 109.564 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.3 m -79.31 157.13 27.77 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -68.17 161.41 27.1 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -64.55 -6.45 7.54 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -81.37 -31.39 33.36 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -72.02 101.96 2.85 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 114.563 -1.199 . . . . 0.0 111.806 -174.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -95.42 -17.08 21.82 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 113.904 -1.498 . . . . 0.0 109.88 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -135.02 148.0 49.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.702 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.4 m -98.06 137.99 36.04 Favored 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 170.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.522 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 52.5 p90 -116.34 142.84 46.32 Favored 'General case' 0 C--N 1.296 -1.757 0 C-N-CA 118.474 -1.291 . . . . 0.0 111.767 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -115.34 122.57 46.28 Favored 'General case' 0 C--N 1.283 -2.311 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -112.81 126.21 55.19 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 29.6 p -92.88 79.99 4.66 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.696 0.76 . . . . 0.0 110.765 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 32' ' ' LEU . . . -71.74 131.67 19.0 Favored Glycine 0 N--CA 1.432 -1.603 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.734 -177.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -55.68 151.47 22.16 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 124.642 1.177 . . . . 0.0 111.66 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.2 110.67 3.05 Favored 'Trans proline' 0 C--O 1.253 1.265 0 C-N-CA 122.383 2.055 . . . . 0.0 112.209 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -114.67 144.01 44.11 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 175.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -62.19 110.31 1.58 Allowed 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.489 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.4 m120 72.73 19.28 4.01 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 125.019 1.328 . . . . 0.0 111.861 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.2 tt -144.6 93.56 2.43 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-O 121.939 0.876 . . . . 0.0 109.088 176.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -93.43 107.19 19.07 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.526 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 66.0 tp -76.84 106.12 8.31 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-O 121.938 0.875 . . . . 0.0 110.555 -177.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' A' ' 33' ' ' ILE . 10.3 mm -124.36 112.99 34.56 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.365 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.929 173.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.1 mt -86.65 -66.37 0.91 Allowed 'General case' 0 N--CA 1.425 -1.713 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.086 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.522 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 28.7 mt-30 40.84 90.39 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 O-C-N 124.684 1.24 . . . . 0.0 113.436 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.12 -154.94 6.27 Favored Glycine 0 C--N 1.288 -2.111 0 C-N-CA 119.274 -1.441 . . . . 0.0 111.744 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.5 m -116.57 137.94 51.79 Favored 'General case' 0 C--N 1.29 -2.006 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 t -134.35 154.69 51.2 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.104 0.478 . . . . 0.0 110.539 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.6 t -87.63 -12.8 44.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.355 0.598 . . . . 0.0 109.397 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.0 m -134.16 165.54 24.84 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.099 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 28.0 t -107.16 117.18 33.39 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 120.684 0.278 . . . . 0.0 110.945 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.424 ' HB3' ' ND2' ' A' ' 47' ' ' ASN . 46.4 t -82.44 117.16 22.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 173.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -94.55 57.81 2.28 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 122.847 1.308 . . . . 0.0 111.603 -175.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.2 p -108.29 172.28 6.93 Favored 'General case' 0 N--CA 1.413 -2.304 0 CA-C-N 114.181 -1.372 . . . . 0.0 107.929 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -87.88 -26.19 22.88 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 119.825 -0.75 . . . . 0.0 110.205 177.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -72.95 -39.62 66.05 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.205 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.424 ' ND2' ' HB3' ' A' ' 42' ' ' SER . 6.2 t30 -114.98 119.3 36.02 Favored 'General case' 0 N--CA 1.422 -1.836 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -107.47 149.27 28.13 Favored 'General case' 0 C--N 1.287 -2.124 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 19.8 p -122.53 145.37 48.39 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.5 p -140.49 149.19 42.2 Favored 'General case' 0 C--N 1.291 -1.968 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 174.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -122.4 71.55 1.02 Allowed 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 121.766 0.793 . . . . 0.0 109.932 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.503 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 6.9 m -149.33 151.49 34.23 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 175.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -67.42 131.95 46.68 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.423 ' HG2' HG21 ' A' ' 9' ' ' VAL . 49.9 mtm180 65.12 21.97 12.24 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.706 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.503 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 27.7 p -73.87 -25.83 60.25 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.9 p-10 -88.24 50.84 2.05 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.276 1.036 . . . . 0.0 111.274 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.486 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 50.6 pttt . . . . . 0 C--N 1.306 -1.308 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.644 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.411 HD13 ' SG ' ' A' ' 19' ' ' CYS . 28.3 mt . . . . . 0 CA--C 1.49 -1.332 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -109.72 108.92 19.47 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.304 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.513 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 79.4 m -134.01 164.96 26.14 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.07 -173.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -84.07 81.43 8.8 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.417 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 9.3 tt0 -79.59 -41.62 26.72 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 121.732 0.777 . . . . 0.0 110.697 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -106.92 20.12 19.48 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 121.706 0.765 . . . . 0.0 109.871 -177.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.28 -24.82 14.55 Favored Glycine 0 CA--C 1.499 -0.968 0 N-CA-C 110.041 -1.223 . . . . 0.0 110.041 -176.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -105.07 158.91 16.24 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.58 121.09 22.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 O-C-N 123.634 0.584 . . . . 0.0 110.178 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.9 m -130.76 151.65 36.26 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.7 m -83.44 115.97 22.3 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.4 m -74.12 154.71 39.03 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -77.57 170.42 16.61 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 118.42 0.555 . . . . 0.0 109.792 -176.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtm180 -62.73 -25.33 68.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.187 0.595 . . . . 0.0 111.126 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -69.16 -30.78 69.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.489 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -82.89 105.29 13.78 Favored 'General case' 0 N--CA 1.426 -1.631 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.591 -177.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -94.95 -14.92 24.0 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.85 -178.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -131.21 145.35 51.89 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.34 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.411 ' SG ' HD13 ' A' ' 1' ' ' LEU . 62.3 m -109.8 133.16 53.46 Favored 'General case' 0 C--N 1.272 -2.776 0 N-CA-C 104.871 -2.27 . . . . 0.0 104.871 171.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 51.4 p90 -116.06 146.36 42.26 Favored 'General case' 0 N--CA 1.42 -1.943 0 C-N-CA 118.702 -1.199 . . . . 0.0 112.551 -177.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 56' ' ' ASN . 21.9 t-160 -124.83 102.3 7.49 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.108 -1.405 . . . . 0.0 107.639 177.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.472 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 3.3 t-20 -88.5 118.54 28.22 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 174.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.7 p -82.6 -22.11 34.92 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 123.808 0.693 . . . . 0.0 110.655 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.47 -146.75 49.11 Favored Glycine 0 N--CA 1.429 -1.807 0 N-CA-C 109.099 -1.6 . . . . 0.0 109.099 -176.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 26.5 mmt -116.82 154.88 49.57 Favored Pre-proline 0 C--N 1.279 -2.461 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 174.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -63.08 112.03 1.57 Allowed 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 121.524 1.483 . . . . 0.0 110.91 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 34.4 m-85 -116.13 140.24 49.5 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.407 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -62.51 107.49 0.95 Allowed 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.908 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.9 m120 59.75 24.53 13.46 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.522 1.129 . . . . 0.0 111.167 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.77 113.02 14.19 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 121.328 0.585 . . . . 0.0 109.852 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -97.71 98.55 9.96 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -80.8 106.69 13.0 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.767 -1.198 . . . . 0.0 107.767 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 33' ' ' ILE . 17.0 mm -117.32 118.26 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.915 0 CA-C-O 121.956 0.884 . . . . 0.0 113.312 -175.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.472 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 6.2 mp -123.05 77.53 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.291 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.417 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 27.2 mt-30 -99.27 116.22 30.94 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 115.023 -0.989 . . . . 0.0 108.689 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.533 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -144.8 -173.37 16.04 Favored Glycine 0 CA--C 1.479 -2.162 0 C-N-CA 119.65 -1.262 . . . . 0.0 111.803 -179.191 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.3 m -113.5 138.13 50.56 Favored 'General case' 0 C--N 1.287 -2.144 0 N-CA-C 106.329 -1.73 . . . . 0.0 106.329 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -132.5 153.24 51.11 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 t -83.91 -46.05 12.54 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -113.87 -177.03 3.03 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.3 t -140.47 129.57 23.53 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.4 m -91.3 100.28 13.11 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 167.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.93 117.55 7.76 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.751 0.786 . . . . 0.0 112.799 -171.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.5 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 1.4 p -149.63 170.21 19.2 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.127 177.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -97.77 -18.49 18.76 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.465 0.65 . . . . 0.0 109.634 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -83.5 -27.69 29.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.108 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.5 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -118.17 95.41 4.88 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.566 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 79.7 tttt -79.0 108.25 12.34 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 114.273 -1.33 . . . . 0.0 110.481 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 28.5 p -100.12 119.85 38.96 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.5 p -130.68 155.96 45.72 Favored 'General case' 0 C--N 1.275 -2.661 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -115.11 21.61 14.07 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -112.77 151.54 30.2 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -65.16 134.89 54.7 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 110.538 -0.171 . . . . 0.0 110.538 -176.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 58.77 23.25 10.98 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.485 1.116 . . . . 0.0 113.029 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.7 p -71.09 -19.5 62.45 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 121.183 0.516 . . . . 0.0 111.472 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.513 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.5 p-10 -90.23 69.41 7.13 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 122.544 1.164 . . . . 0.0 110.998 -178.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttp . . . . . 0 N--CA 1.428 -1.535 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.691 -179.3 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.43 HD13 ' SG ' ' A' ' 19' ' ' CYS . 18.5 mt . . . . . 0 CA--C 1.487 -1.462 0 CA-C-O 121.037 0.446 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -110.38 113.67 26.51 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 5.5 m -123.87 164.18 19.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -172.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.412 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 81.6 m-85 -84.87 84.02 7.85 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -71.7 -42.42 67.4 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.19 -1.004 . . . . 0.0 110.584 178.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -106.02 7.12 31.77 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.56 0.695 . . . . 0.0 109.704 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.38 -14.58 63.3 Favored Glycine 0 C--N 1.31 -0.876 0 N-CA-C 107.926 -2.07 . . . . 0.0 107.926 -170.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.2 mttm -104.96 150.75 24.65 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.3 t -73.23 122.2 25.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 123.744 0.653 . . . . 0.0 110.384 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 20.8 m -121.57 151.07 24.83 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 90.8 m -84.01 113.34 20.93 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.5 m -83.77 143.5 29.93 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -65.95 169.5 6.65 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.225 0.466 . . . . 0.0 110.759 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -63.81 -9.78 16.62 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 124.295 1.038 . . . . 0.0 113.09 -176.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -82.73 -29.0 30.07 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.439 ' HA ' ' HA ' ' A' ' 39' ' ' SER . 1.3 mpt? -81.98 101.65 10.44 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.529 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.09 -6.61 31.34 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.566 -177.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -134.8 148.61 50.23 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.267 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.43 ' SG ' HD13 ' A' ' 1' ' ' LEU . 25.3 m -99.77 137.18 38.6 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 171.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -112.35 147.29 36.68 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 118.173 -1.411 . . . . 0.0 111.313 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.4 t-160 -126.7 101.57 6.68 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 114.515 -1.22 . . . . 0.0 107.823 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.554 HD22 ' HB2' ' A' ' 47' ' ' ASN . 25.2 t-20 -101.07 115.01 29.49 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 175.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.5 p -79.38 -27.86 41.9 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.094 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.38 -146.66 49.08 Favored Glycine 0 N--CA 1.427 -1.912 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.291 178.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 69.5 mtm -90.91 138.21 26.31 Favored Pre-proline 0 C--N 1.292 -1.892 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.9 123.96 9.31 Favored 'Trans proline' 0 C--O 1.252 1.185 0 C-N-CA 122.465 2.11 . . . . 0.0 110.851 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.457 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 61.1 m-85 -123.84 143.33 50.4 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.328 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -71.05 114.43 9.09 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.698 -176.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 67.1 t30 66.33 26.51 10.26 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.9 1.28 . . . . 0.0 110.07 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.457 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 3.1 tm? -130.87 129.08 41.84 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -102.29 94.89 5.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.493 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.7 tp -78.17 109.58 12.4 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.197 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.6 mm -113.55 101.65 12.77 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.646 0 CA-C-O 121.347 0.594 . . . . 0.0 111.671 -176.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.46 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 9.6 mp -109.64 61.48 0.6 Allowed 'General case' 0 C--N 1.306 -1.325 0 CA-C-O 122.269 1.033 . . . . 0.0 108.794 171.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -96.71 130.39 43.95 Favored 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.63 -160.41 8.76 Favored Glycine 0 C--N 1.278 -2.668 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.938 178.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 m -119.87 135.99 54.66 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.8 t -133.72 150.85 51.51 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.255 0.55 . . . . 0.0 110.82 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 16' ' ' MET . 13.1 t -77.17 -45.47 26.59 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.385 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.5 m -119.69 -175.79 3.03 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 43.2 t -125.46 138.69 54.01 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.003 0.43 . . . . 0.0 110.62 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.3 p -88.88 173.51 8.48 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 123.482 0.713 . . . . 0.0 110.652 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -91.92 17.73 8.83 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.112 0.482 . . . . 0.0 111.011 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.44 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 7.8 p -82.38 146.03 29.58 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.741 -175.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.08 -26.2 14.3 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -74.58 -27.16 60.37 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.554 ' HB2' HD22 ' A' ' 22' ' ' ASN . 8.9 t30 -115.81 96.75 5.75 Favored 'General case' 0 N--CA 1.416 -2.142 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 174.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -87.82 154.28 20.67 Favored 'General case' 0 C--N 1.281 -2.408 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.131 -176.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 31.5 p -130.03 142.68 50.59 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 p -140.21 147.52 40.19 Favored 'General case' 0 C--N 1.278 -2.523 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 26.0 t -116.93 68.49 0.74 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.925 0.869 . . . . 0.0 110.968 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.0 m -148.78 144.99 27.37 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -69.54 130.59 42.87 Favored 'General case' 0 C--N 1.287 -2.129 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.499 -177.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.4 mtp-105 69.19 26.4 5.48 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.599 1.159 . . . . 0.0 111.524 -178.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.502 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 28.4 p -78.71 -26.37 44.83 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 178.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.431 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 32.3 p-10 -83.45 70.61 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.839 1.304 . . . . 0.0 110.044 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.428 -1.541 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.896 -172.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.428 HD13 ' SG ' ' A' ' 19' ' ' CYS . 19.5 mt . . . . . 0 CA--C 1.478 -1.807 0 CA-C-O 120.556 0.217 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 10.5 ptpp? -109.23 112.34 24.44 Favored 'General case' 0 N--CA 1.414 -2.238 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 174.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 74.0 m -136.26 165.06 26.64 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.197 -175.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.441 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 92.7 m-85 -82.02 63.0 6.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.415 0.626 . . . . 0.0 110.611 -176.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.515 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 8.2 tt0 -70.61 -31.99 69.17 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.927 -175.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -106.21 -7.36 17.9 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 122.155 0.979 . . . . 0.0 109.297 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 109.39 -18.07 30.61 Favored Glycine 0 C--N 1.305 -1.146 0 N-CA-C 108.099 -2.001 . . . . 0.0 108.099 -171.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 62.2 mttp -104.76 155.54 18.79 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.538 -1.331 . . . . 0.0 107.649 175.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.8 t -73.18 108.24 4.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.46 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 29.5 m -123.54 151.04 27.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 94.6 m -82.37 108.18 15.6 Favored 'General case' 0 N--CA 1.418 -2.073 0 CA-C-O 121.475 0.655 . . . . 0.0 109.524 176.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 58.3 m -76.7 136.94 39.11 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 176.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -57.21 162.35 2.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.568 0.747 . . . . 0.0 111.227 -172.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -62.33 -17.42 58.8 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -176.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 39' ' ' SER . 7.0 m-20 -71.01 -30.35 66.56 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.756 0.789 . . . . 0.0 109.117 176.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -79.03 101.41 7.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.451 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -91.92 -22.19 20.18 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.028 -178.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -127.42 137.31 52.69 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.479 -172.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.428 ' SG ' HD13 ' A' ' 1' ' ' LEU . 60.2 m -103.49 127.82 50.81 Favored 'General case' 0 C--N 1.279 -2.468 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -109.57 159.73 16.84 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.767 -0.773 . . . . 0.0 111.948 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.417 ' NE2' ' HB ' ' A' ' 23' ' ' THR . 7.8 t-160 -129.99 101.46 5.85 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.859 177.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.558 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.0 t-20 -101.36 118.23 36.56 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.417 ' HB ' ' NE2' ' A' ' 21' ' ' HIS . 8.9 t -118.63 134.66 54.95 Favored 'General case' 0 C--N 1.287 -2.122 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.063 -177.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.37 171.88 48.33 Favored Glycine 0 N--CA 1.432 -1.578 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 176.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 64.4 mtt -75.9 147.04 80.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.83 106.08 0.6 Allowed 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 122.401 2.067 . . . . 0.0 112.892 -178.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.444 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 56.1 m-85 -121.97 144.34 48.94 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -58.18 121.64 11.21 Favored 'General case' 0 C--O 1.242 0.709 0 O-C-N 123.402 0.439 . . . . 0.0 110.578 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 69.05 7.68 6.38 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.682 1.193 . . . . 0.0 112.502 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 59.6 tp -126.95 102.88 7.19 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.103 0.477 . . . . 0.0 110.654 -178.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -110.64 98.98 8.02 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 tp -93.61 106.13 18.12 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.263 0.554 . . . . 0.0 109.58 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.431 HG23 ' HG3' ' A' ' 35' ' ' GLN . 15.4 mm -123.69 112.21 32.24 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.264 178.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.558 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.1 mt -119.83 70.55 0.86 Allowed 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 121.691 0.758 . . . . 0.0 109.203 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.431 ' HG3' HG23 ' A' ' 33' ' ' ILE . 26.2 mt-30 -86.06 118.73 25.71 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 173.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.515 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -139.53 -160.17 8.25 Favored Glycine 0 N--CA 1.425 -2.042 0 C-N-CA 120.002 -1.094 . . . . 0.0 112.506 -175.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 74.1 m -135.13 135.75 41.37 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 t -133.78 156.56 47.78 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 121.305 0.574 . . . . 0.0 110.836 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 18.2 m -76.59 -33.47 58.44 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.082 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.1 m -141.92 139.31 32.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.64 165.41 11.45 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.4 p -95.6 169.17 10.22 Favored 'General case' 0 N--CA 1.42 -1.94 0 C-N-CA 124.5 1.12 . . . . 0.0 110.566 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -93.34 27.93 2.4 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.612 0.72 . . . . 0.0 110.144 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.483 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.7 p -74.88 144.15 43.5 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.678 -178.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.39 -29.34 18.09 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -73.08 -44.34 60.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.102 176.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.483 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.8 t30 -93.15 99.17 11.8 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 176.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -89.29 151.61 22.01 Favored 'General case' 0 C--N 1.282 -2.327 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.5 -174.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.0 p -147.16 144.49 29.02 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.7 p -139.51 155.51 47.49 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 114.49 -1.232 . . . . 0.0 107.822 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -113.63 32.77 5.58 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.1 m -119.95 150.4 40.56 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -65.69 129.92 41.48 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.533 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.6 mtp180 61.81 27.09 16.51 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.491 -1.232 . . . . 0.0 112.577 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 30.1 p -77.56 -25.14 49.8 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.446 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.538 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 37.1 p-10 -83.59 73.8 10.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 122.947 1.356 . . . . 0.0 110.315 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.294 -1.832 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.271 -177.044 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.414 HD13 ' SG ' ' A' ' 19' ' ' CYS . 30.8 mt . . . . . 0 CA--C 1.488 -1.423 0 CA-C-O 121.203 0.525 . . . . 0.0 111.905 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.406 ' HB2' ' CG1' ' A' ' 9' ' ' VAL . 20.3 pttp -110.77 113.95 26.93 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.203 172.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.49 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 85.0 m -135.82 164.02 28.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.274 0.559 . . . . 0.0 112.212 -174.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -81.39 85.02 6.51 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 122.129 -0.357 . . . . 0.0 111.324 -174.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 10.0 tt0 -81.4 -43.2 19.31 Favored 'General case' 0 C--N 1.31 -1.125 0 C-N-CA 118.754 -1.178 . . . . 0.0 112.103 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -107.0 19.35 20.57 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 121.578 0.704 . . . . 0.0 111.259 -178.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.13 -38.05 3.46 Favored Glycine 0 CA--C 1.497 -1.049 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 -176.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -100.5 163.44 12.36 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.406 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 41.0 t -72.86 132.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 O-C-N 123.557 0.536 . . . . 0.0 111.244 -176.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.464 HG21 HE21 ' A' ' 5' ' ' GLN . 16.5 m -126.41 152.09 33.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 174.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.45 120.46 29.84 Favored 'General case' 0 C--N 1.283 -2.317 0 C-N-CA 120.2 -0.6 . . . . 0.0 109.947 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.4 m -80.47 143.88 33.01 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 106.808 -1.552 . . . . 0.0 106.808 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -74.07 169.35 17.68 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -70.11 -7.59 42.73 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.8 -29.64 56.08 Favored 'General case' 0 CA--C 1.495 -1.141 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -77.91 126.52 30.97 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.326 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -108.18 -24.92 11.32 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.156 -175.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -133.73 143.63 48.6 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.204 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.414 ' SG ' HD13 ' A' ' 1' ' ' LEU . 61.6 m -102.56 119.9 39.62 Favored 'General case' 0 C--N 1.278 -2.51 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 170.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.9 p90 -99.59 149.53 23.17 Favored 'General case' 0 N--CA 1.42 -1.926 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.811 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 -125.73 101.82 7.04 Favored 'General case' 0 C--N 1.278 -2.523 0 CA-C-N 114.545 -1.207 . . . . 0.0 107.855 178.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.452 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.3 t30 -110.3 106.91 16.47 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.2 t -100.37 170.89 8.11 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -99.69 -165.17 29.32 Favored Glycine 0 C--N 1.3 -1.446 0 C-N-CA 119.738 -1.22 . . . . 0.0 111.047 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 86.1 mtp -74.06 133.48 78.53 Favored Pre-proline 0 C--N 1.3 -1.556 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 174.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.4 104.47 0.52 Allowed 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.902 1.735 . . . . 0.0 112.975 -176.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -133.21 143.67 49.3 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 114.865 -1.062 . . . . 0.0 108.444 176.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.497 ' HA ' ' NE ' ' A' ' 28' ' ' ARG . 2.0 mmp_? -70.79 129.82 40.09 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 73.69 17.05 3.75 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.652 1.181 . . . . 0.0 111.201 -176.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.79 91.58 3.59 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -104.04 105.14 15.22 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 68.0 tp -104.54 106.69 17.28 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 mm -103.66 103.39 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.094 0 CA-C-O 121.809 0.814 . . . . 0.0 111.147 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 84.2 mt -123.58 63.53 1.03 Allowed 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 170.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.533 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 21.3 mt-30 -109.5 114.95 29.01 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.974 -1.467 . . . . 0.0 107.247 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.55 -170.72 13.97 Favored Glycine 0 C--N 1.286 -2.209 0 C-N-CA 119.314 -1.422 . . . . 0.0 112.174 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 20.8 m -111.44 132.14 54.69 Favored 'General case' 0 C--N 1.285 -2.219 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -133.85 154.32 51.11 Favored 'General case' 0 C--N 1.302 -1.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.755 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -86.69 -11.3 51.63 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.358 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.5 m -141.47 -169.05 2.79 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.7 t -148.7 151.55 35.11 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.7 t -114.03 110.48 20.11 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 170.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -70.81 97.33 1.37 Allowed 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 122.825 1.298 . . . . 0.0 111.273 -176.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.401 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 24.9 p -135.91 178.15 7.28 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.962 -176.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -94.95 -28.21 15.28 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.344 0.592 . . . . 0.0 109.752 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -88.3 -36.6 16.58 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.985 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.401 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.5 t30 -102.76 106.08 16.63 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -94.07 153.67 18.02 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.146 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.2 m -132.31 124.84 29.61 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.6 p -129.59 147.11 51.35 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -114.48 25.67 10.84 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -174.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.5 m -114.05 147.02 39.4 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -66.87 133.04 49.26 Favored 'General case' 0 C--N 1.302 -1.487 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.4 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 66.19 18.77 11.02 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 124.83 1.252 . . . . 0.0 112.693 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.5 p -65.35 -31.87 73.22 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.101 0.477 . . . . 0.0 111.685 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.522 HD22 ' HB3' ' A' ' 35' ' ' GLN . 36.9 p-10 -83.87 47.51 1.31 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 122.175 0.988 . . . . 0.0 111.107 -176.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt . . . . . 0 C--O 1.249 1.054 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.011 178.884 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.472 HD13 ' SG ' ' A' ' 19' ' ' CYS . 33.9 mt . . . . . 0 CA--C 1.472 -2.048 0 CA-C-O 120.712 0.291 . . . . 0.0 110.915 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.45 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 23.3 pttm -109.04 106.68 16.72 Favored 'General case' 0 N--CA 1.411 -2.409 0 CA-C-O 121.615 0.722 . . . . 0.0 109.121 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 85.3 m -131.07 166.14 21.71 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.83 -174.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -77.37 74.3 3.93 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.458 ' HA ' ' HA2' ' A' ' 36' ' ' GLY . 1.0 OUTLIER -85.85 -42.04 14.47 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.669 0.747 . . . . 0.0 109.337 178.324 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 67.3 t60 -100.42 20.46 14.83 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 122.329 1.061 . . . . 0.0 108.939 -175.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.54 -35.66 3.79 Favored Glycine 0 CA--C 1.496 -1.141 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -176.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -104.46 163.13 12.67 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.9 t -68.09 114.37 4.87 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 123.893 0.746 . . . . 0.0 109.043 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 35.8 m -128.85 151.98 36.38 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.445 -177.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.7 m -76.3 106.27 7.82 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.709 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.0 m -79.49 144.62 33.82 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -63.68 167.77 5.51 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.331 0.652 . . . . 0.0 112.466 -170.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -55.53 -23.31 25.73 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 125.064 1.346 . . . . 0.0 112.595 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 39' ' ' SER . 15.7 m-20 -84.35 -26.62 28.31 Favored 'General case' 0 CA--C 1.491 -1.289 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -175.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -74.32 101.67 4.12 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.25 -177.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.414 ' HG3' ' O ' ' A' ' 15' ' ' ASP . 47.1 mttp -94.42 -22.83 18.05 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.01 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -128.39 148.41 50.69 Favored 'General case' 0 N--CA 1.429 -1.525 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.369 -173.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.472 ' SG ' HD13 ' A' ' 1' ' ' LEU . 57.3 m -106.32 136.22 46.44 Favored 'General case' 0 C--N 1.273 -2.731 0 N-CA-C 104.565 -2.383 . . . . 0.0 104.565 170.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 43.4 p90 -125.59 152.98 44.38 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.87 -174.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.7 t-160 -130.4 102.61 6.25 Favored 'General case' 0 N--CA 1.421 -1.904 0 CA-C-N 113.886 -1.506 . . . . 0.0 107.007 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.601 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 5.0 t30 -90.27 102.29 15.02 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.0 p -67.85 -43.34 79.71 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.228 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.34 -152.52 41.66 Favored Glycine 0 N--CA 1.424 -2.121 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -176.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.471 ' HB2' ' CZ ' ' A' ' 27' ' ' PHE . 4.2 mpp? -85.13 142.36 38.31 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -66.66 114.92 3.29 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.098 1.866 . . . . 0.0 109.947 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.471 ' CZ ' ' HB2' ' A' ' 25' ' ' MET . 52.3 m-85 -117.47 140.66 49.31 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 121.567 0.698 . . . . 0.0 110.614 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -91.87 127.88 37.5 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.121 -0.945 . . . . 0.0 108.726 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 65.9 t30 68.75 22.39 7.39 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.357 1.063 . . . . 0.0 110.064 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.1 tp -143.52 135.07 26.25 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.63 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -110.06 99.5 8.58 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.097 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -81.1 106.12 12.85 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 176.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.447 HD13 ' HA ' ' A' ' 33' ' ' ILE . 23.0 mm -112.15 115.01 48.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.769 0 CA-C-O 121.637 0.732 . . . . 0.0 112.74 -174.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.601 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 81.8 mt -133.94 72.84 1.48 Allowed 'General case' 0 N--CA 1.423 -1.808 0 CA-C-N 113.72 -1.582 . . . . 0.0 107.436 172.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -112.89 110.0 19.8 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.935 -177.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.458 ' HA2' ' HA ' ' A' ' 5' ' ' GLN . . . -145.19 -154.34 6.12 Favored Glycine 0 C--N 1.295 -1.75 0 C-N-CA 119.707 -1.235 . . . . 0.0 112.582 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.1 m -126.96 136.16 51.88 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 175.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.421 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 41.2 t -122.34 144.25 49.13 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.557 0.694 . . . . 0.0 111.663 -173.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 15.9 m -86.14 -30.2 22.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.724 178.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.2 m -142.19 104.27 4.42 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 11.0 t -116.52 136.85 52.64 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.634 -167.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.4 m -96.45 105.55 17.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.63 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.417 ' HG2' ' HB2' ' A' ' 49' ' ' CYS . 34.3 mt-10 -66.46 104.95 1.35 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.598 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -137.8 175.05 9.94 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.86 -36.52 64.87 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 176.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -63.76 -59.91 3.97 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.378 -1.283 . . . . 0.0 110.073 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.457 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 8.0 t30 -106.45 105.01 14.84 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.271 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 39.2 ttpt -86.22 116.71 24.57 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.17 -178.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.417 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 20.7 m -104.75 132.55 50.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.2 p -139.92 155.6 47.09 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.4 p -126.62 72.71 1.35 Allowed 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.819 0.819 . . . . 0.0 111.73 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.479 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 4.6 m -149.35 151.29 33.87 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 175.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.45 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 11.3 m-20 -66.86 126.08 27.93 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -177.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 69.93 18.88 7.16 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.499 1.52 . . . . 0.0 112.689 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.479 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.5 p -70.4 -20.35 62.94 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -176.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 28.9 p-10 -89.52 33.77 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.553 0.692 . . . . 0.0 110.786 -177.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 C--N 1.314 -0.935 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.574 -179.266 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 1' ' ' LEU . 21.5 mt . . . . . 0 CA--C 1.497 -1.09 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 11' ' ' THR . 21.8 pttp -110.91 116.18 30.79 Favored 'General case' 0 C--N 1.278 -2.518 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 169.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.5 m -133.78 165.22 25.48 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-O 121.125 0.488 . . . . 0.0 111.567 -172.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.569 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 89.6 m-85 -83.65 86.57 7.1 Favored 'General case' 0 C--O 1.189 -2.087 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 -174.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -76.88 -41.48 43.6 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.033 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -105.85 12.17 31.05 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.555 -177.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.77 -10.53 72.0 Favored Glycine 0 CA--C 1.517 0.217 0 N-CA-C 109.196 -1.562 . . . . 0.0 109.196 -171.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.535 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.3 mttt -105.51 153.29 21.94 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 176.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 28.0 t -76.93 108.89 10.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 O-C-N 123.316 0.385 . . . . 0.0 110.152 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.4 m -123.85 151.26 28.59 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 25.8 m -82.75 129.25 34.95 Favored 'General case' 0 C--N 1.285 -2.218 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -178.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 60.4 m -74.05 158.08 34.93 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.611 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 20.9 t-80 -70.71 165.53 22.79 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 -176.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -68.59 3.73 1.71 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -176.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.71 -12.75 15.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.552 0.692 . . . . 0.0 109.332 177.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.611 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -86.9 117.2 25.48 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.703 -172.033 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -104.57 -21.54 13.41 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 114.344 -1.298 . . . . 0.0 109.907 -177.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -128.86 150.0 50.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.84 -177.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 64.9 m -109.26 136.87 48.01 Favored 'General case' 0 C--N 1.276 -2.611 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -120.54 152.82 37.57 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.051 -176.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -134.68 101.87 5.09 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 177.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.547 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 5.2 t30 -97.74 104.7 16.75 Favored 'General case' 0 CA--C 1.485 -1.532 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.3 p -66.14 -36.47 83.22 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 123.797 0.686 . . . . 0.0 112.131 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 67.63 -132.09 29.36 Favored Glycine 0 N--CA 1.427 -1.945 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.39 124.28 36.22 Favored Pre-proline 0 C--N 1.282 -2.334 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -79.07 120.02 4.46 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.545 2.164 . . . . 0.0 111.37 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.459 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 96.9 m-85 -117.16 142.96 46.36 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -66.88 125.68 26.68 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.866 -0.607 . . . . 0.0 109.972 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 68.13 21.97 8.47 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.815 1.246 . . . . 0.0 111.586 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.459 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 54.7 tp -141.25 103.04 4.35 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.339 0.59 . . . . 0.0 111.092 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -83.75 98.25 9.58 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 tt -77.17 106.4 8.86 Favored 'General case' 0 N--CA 1.424 -1.774 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 177.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.411 HG23 ' HG3' ' A' ' 35' ' ' GLN . 26.1 mm -104.57 111.26 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.743 -172.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.547 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 62.0 mt -126.28 59.33 1.34 Allowed 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.192 -1.367 . . . . 0.0 108.057 172.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.411 ' HG3' HG23 ' A' ' 33' ' ' ILE . 53.9 mt-30 -93.5 125.38 38.08 Favored 'General case' 0 N--CA 1.421 -1.898 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 176.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -146.4 -163.61 10.49 Favored Glycine 0 C--N 1.27 -3.124 0 C-N-CA 119.204 -1.475 . . . . 0.0 112.961 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 60.9 m -131.49 134.94 46.66 Favored 'General case' 0 C--N 1.286 -2.185 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 t -134.01 162.45 32.04 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.317 0.58 . . . . 0.0 110.217 -176.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.4 t -90.82 -15.73 29.53 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 177.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.4 m -132.7 -171.26 2.62 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.359 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.8 t -121.66 165.52 15.63 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.9 p -80.39 165.1 22.56 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 123.73 0.812 . . . . 0.0 112.007 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -85.83 -20.84 28.54 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.934 173.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 t -99.47 156.5 17.0 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.843 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -89.47 -15.61 32.69 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 123.972 0.795 . . . . 0.0 109.465 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -58.19 -32.12 67.95 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 122.618 1.199 . . . . 0.0 109.019 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 22' ' ' ASN . 6.4 t30 -105.58 113.95 27.82 Favored 'General case' 0 N--CA 1.409 -2.502 0 CA-C-N 113.508 -1.678 . . . . 0.0 107.788 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -89.08 142.27 27.78 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.1 p -124.7 135.71 53.27 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.1 p -139.92 156.65 46.57 Favored 'General case' 0 C--N 1.269 -2.906 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 p -117.72 29.12 8.02 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -173.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.0 m -129.14 154.43 46.73 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.059 0.457 . . . . 0.0 110.985 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -50.98 124.51 11.48 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 124.06 0.944 . . . . 0.0 112.363 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 58.29 27.43 15.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.579 1.151 . . . . 0.0 113.68 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 29.2 p -76.59 -25.12 53.6 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -87.31 33.67 0.69 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -171.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.569 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 14.4 ptmm? . . . . . 0 C--N 1.302 -1.471 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.457 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.433 HD13 ' SG ' ' A' ' 19' ' ' CYS . 27.7 mt . . . . . 0 CA--C 1.479 -1.769 0 CA-C-O 121.574 0.702 . . . . 0.0 111.773 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 47.4 pttt -109.75 108.56 18.96 Favored 'General case' 0 C--N 1.28 -2.449 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.843 174.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.544 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 71.9 m -133.23 165.12 25.54 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.788 -173.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.46 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 91.8 m-85 -81.98 74.19 8.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.237 0.541 . . . . 0.0 110.623 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.533 ' HG3' ' HA2' ' A' ' 36' ' ' GLY . 8.2 tt0 -85.04 -35.83 21.63 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-O 121.444 0.64 . . . . 0.0 112.103 -177.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -105.81 9.44 32.91 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 122.26 1.029 . . . . 0.0 108.336 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 103.39 -38.33 3.28 Favored Glycine 0 CA--C 1.498 -1.009 0 N-CA-C 108.252 -1.939 . . . . 0.0 108.252 -174.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -93.05 162.81 13.89 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 113.925 -1.137 . . . . 0.0 108.217 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.406 ' CG1' ' HB2' ' A' ' 2' ' ' LYS . 57.6 t -71.77 123.2 25.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 16.5 m -120.48 152.12 23.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.7 m -88.67 103.02 15.54 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.7 m -82.43 142.06 32.25 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 -69.66 170.88 9.95 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.4 mtm180 -76.32 -4.16 40.64 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -69.26 -31.62 70.27 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 171.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -82.14 101.32 10.35 Favored 'General case' 0 N--CA 1.422 -1.839 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.853 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -102.37 -8.27 21.32 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.278 -177.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -134.71 136.11 42.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.257 -178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.433 ' SG ' HD13 ' A' ' 1' ' ' LEU . 82.9 m -101.69 136.41 41.57 Favored 'General case' 0 C--N 1.28 -2.447 0 N-CA-C 105.25 -2.129 . . . . 0.0 105.25 170.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.411 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 51.3 p90 -120.72 147.35 45.41 Favored 'General case' 0 C--N 1.293 -1.852 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.335 -176.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.459 ' NE2' ' HB ' ' A' ' 23' ' ' THR . 12.8 t-160 -120.21 102.31 8.41 Favored 'General case' 0 C--N 1.279 -2.499 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 172.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.564 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 6.3 t30 -104.64 102.82 12.4 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.459 ' HB ' ' NE2' ' A' ' 21' ' ' HIS . 9.9 t -102.04 -162.96 0.97 Allowed 'General case' 0 C--N 1.273 -2.72 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.32 -102.68 0.27 Allowed Glycine 0 N--CA 1.416 -2.66 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.1 mtt -128.38 157.84 73.37 Favored Pre-proline 0 C--N 1.285 -2.228 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.65 105.46 1.1 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.4 1.4 . . . . 0.0 110.224 176.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -91.21 143.69 26.4 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.115 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.67 118.0 20.35 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.115 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 66.32 18.91 10.99 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.921 0.888 . . . . 0.0 111.735 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.0 tp -145.67 132.14 19.73 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -117.53 106.35 13.05 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 66.3 tp -80.96 106.22 12.79 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.467 HG23 ' HG3' ' A' ' 35' ' ' GLN . 25.1 mm -115.24 96.52 4.68 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.14 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.142 -177.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.564 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 84.2 mt -106.77 61.32 0.63 Allowed 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 173.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 23.5 mt-30 -97.93 120.13 37.77 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.533 ' HA2' ' HG3' ' A' ' 5' ' ' GLN . . . -145.84 -163.3 10.19 Favored Glycine 0 C--N 1.284 -2.325 0 C-N-CA 119.813 -1.184 . . . . 0.0 112.636 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.0 m -122.17 137.68 54.74 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 173.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -133.68 157.43 45.83 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 t -81.37 -43.25 19.27 Favored 'General case' 0 N--CA 1.416 -2.127 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.0 p -105.58 178.85 4.44 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.9 t -120.52 126.65 50.89 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 120.491 0.186 . . . . 0.0 110.906 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.1 m -82.0 85.33 6.74 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.31 99.97 0.77 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.639 1.209 . . . . 0.0 113.023 -173.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.403 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 9.4 p -148.82 175.74 10.99 Favored 'General case' 0 C--N 1.282 -2.359 0 CA-C-N 113.012 -1.904 . . . . 0.0 107.006 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -89.86 -32.55 16.84 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.052 0.454 . . . . 0.0 110.968 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -79.31 -36.91 38.86 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.807 0.337 . . . . 0.0 111.4 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.403 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 7.1 t30 -94.31 99.58 11.78 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 174.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -89.99 114.53 26.39 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.516 -174.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 32.0 p -104.2 136.02 44.59 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.38 176.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 3.7 p -139.54 155.6 47.41 Favored 'General case' 0 C--N 1.282 -2.361 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.997 -179.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -112.3 25.83 11.15 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.409 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 1.7 m -116.36 148.53 40.53 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -66.02 126.05 27.38 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 120.734 0.302 . . . . 0.0 111.175 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 65.7 24.75 11.53 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 124.843 1.257 . . . . 0.0 112.396 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.409 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 26.1 p -70.92 -19.56 62.57 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.177 0.513 . . . . 0.0 111.863 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.544 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 36.4 p-10 -89.43 70.54 8.06 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 122.469 1.128 . . . . 0.0 110.522 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.46 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 22.0 pttp . . . . . 0 C--N 1.306 -1.32 0 CA-C-N 114.711 -1.131 . . . . 0.0 110.971 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 34.7 mt . . . . . 0 CA--C 1.484 -1.564 0 CA-C-O 120.858 0.361 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -110.92 113.58 26.26 Favored 'General case' 0 N--CA 1.415 -2.186 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.6 m -128.5 164.22 23.26 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.447 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 89.9 m-85 -82.78 76.94 9.6 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 122.37 -0.206 . . . . 0.0 111.371 -177.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.546 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.6 tt0 -77.92 -42.37 33.37 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.509 0.671 . . . . 0.0 111.187 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -90.91 -2.26 57.75 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.06 -14.96 62.17 Favored Glycine 0 C--N 1.307 -1.079 0 N-CA-C 107.242 -2.343 . . . . 0.0 107.242 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 95.4 mttt -105.03 155.82 18.62 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 176.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.3 t -70.87 113.13 6.52 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.1 m -125.88 152.22 32.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 16.1 m -82.37 126.62 32.39 Favored 'General case' 0 C--N 1.295 -1.8 0 CA-C-O 121.185 0.517 . . . . 0.0 110.227 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.9 m -82.74 153.63 25.19 Favored 'General case' 0 C--N 1.297 -1.707 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.426 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.8 t-80 -67.62 160.88 26.97 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -62.88 -12.55 25.72 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -176.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -81.89 -24.34 35.75 Favored 'General case' 0 CA--C 1.504 -0.818 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.426 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.3 OUTLIER -73.51 126.0 29.23 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.699 -172.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -113.19 -24.25 9.52 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.13 -175.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -130.43 148.56 52.26 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.074 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.9 m -96.26 142.52 28.32 Favored 'General case' 0 C--N 1.286 -2.153 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 169.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.442 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 45.5 p90 -123.17 154.53 38.57 Favored 'General case' 0 C--N 1.294 -1.811 0 C-N-CA 118.466 -1.293 . . . . 0.0 111.429 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -131.97 106.05 7.8 Favored 'General case' 0 C--N 1.289 -2.048 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 174.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.436 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 27.0 t-20 -97.08 133.29 41.94 Favored 'General case' 0 C--N 1.289 -2.058 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 175.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.3 t -154.65 -164.35 1.8 Allowed 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 -175.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -163.97 -75.65 0.03 OUTLIER Glycine 0 CA--C 1.476 -2.378 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 178.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 88.0 mtp -137.55 157.56 73.55 Favored Pre-proline 0 C--N 1.274 -2.71 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 175.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.62 143.64 24.33 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.946 1.764 . . . . 0.0 109.536 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.418 ' CB ' ' HB3' ' A' ' 30' ' ' LEU . 83.6 m-85 -116.18 142.9 46.21 Favored 'General case' 0 C--N 1.281 -2.4 0 CA-C-O 121.303 0.573 . . . . 0.0 112.221 -178.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -65.98 104.64 1.16 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.204 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 71.31 19.43 5.34 Favored 'General case' 0 CA--C 1.508 -0.637 0 C-N-CA 124.564 1.145 . . . . 0.0 111.301 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.418 ' HB3' ' CB ' ' A' ' 27' ' ' PHE . 66.0 tp -126.89 105.16 8.44 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 176.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -81.83 92.44 6.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 tt -82.9 106.26 14.58 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 20.9 mm -124.01 96.78 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.614 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.91 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.436 ' CB ' ' HB3' ' A' ' 22' ' ' ASN . 10.1 mp -104.98 60.91 0.69 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 170.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.563 ' HB3' HD22 ' A' ' 56' ' ' ASN . 25.8 mt-30 -103.45 126.52 50.65 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.583 -1.189 . . . . 0.0 108.262 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.04 -158.14 7.52 Favored Glycine 0 C--N 1.265 -3.39 0 C-N-CA 119.713 -1.232 . . . . 0.0 111.227 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 27.0 m -128.32 134.52 48.91 Favored 'General case' 0 C--N 1.281 -2.383 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.0 t -133.6 157.26 46.18 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.299 0.571 . . . . 0.0 110.245 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 m -87.8 -15.77 35.97 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.015 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.8 t -141.35 174.15 10.81 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.7 t -113.95 148.95 36.0 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 t -92.0 161.44 14.79 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -90.93 -12.45 36.01 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.985 0.421 . . . . 0.0 110.91 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -79.37 144.02 34.55 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-O 121.013 0.435 . . . . 0.0 110.478 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -2.88 53.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.991 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -76.89 -17.44 58.94 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.686 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -120.93 104.66 9.99 Favored 'General case' 0 N--CA 1.428 -1.572 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 175.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 53.4 mtpt -84.64 125.44 32.48 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.381 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.1 m -110.85 134.62 52.38 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.5 p -139.99 144.08 36.81 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.5 p -113.89 49.25 1.0 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -174.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -138.55 147.19 42.79 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 106.136 -1.801 . . . . 0.0 106.136 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -66.95 136.37 55.24 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.058 -177.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 63.72 19.77 11.89 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.438 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 26.0 p -68.12 -26.99 66.07 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.971 0.415 . . . . 0.0 110.841 177.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.563 HD22 ' HB3' ' A' ' 35' ' ' GLN . 36.2 p-10 -82.81 55.14 2.93 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 122.934 1.349 . . . . 0.0 111.09 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt . . . . . 0 N--CA 1.43 -1.474 0 CA-C-N 114.193 -1.367 . . . . 0.0 110.196 -179.508 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.555 ' HB3' ' SG ' ' A' ' 3' ' ' CYS . 35.9 mt . . . . . 0 CA--C 1.482 -1.665 0 CA-C-O 121.095 0.474 . . . . 0.0 111.635 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 22.9 pttm -109.93 112.51 24.57 Favored 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 172.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.555 ' SG ' ' HB3' ' A' ' 1' ' ' LEU . 3.6 m -129.63 163.99 24.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 121.025 0.44 . . . . 0.0 110.622 -170.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.521 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 93.1 m-85 -81.36 90.48 6.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -83.95 -42.78 15.91 Favored 'General case' 0 C--N 1.308 -1.212 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.189 178.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -106.48 14.69 26.86 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.587 0.708 . . . . 0.0 109.181 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.2 -16.41 61.36 Favored Glycine 0 C--N 1.31 -0.91 0 N-CA-C 108.634 -1.786 . . . . 0.0 108.634 -172.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 92.1 mttt -105.09 159.01 16.17 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 56.3 t -81.4 119.05 30.24 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 123.612 0.57 . . . . 0.0 110.366 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 18.2 m -118.74 151.66 20.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.1 m -85.06 110.7 19.13 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.194 0.521 . . . . 0.0 109.752 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.4 m -85.77 140.76 30.2 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.986 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -71.42 172.35 9.62 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.769 -171.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -66.9 -10.55 49.82 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.506 1.122 . . . . 0.0 112.576 -177.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.407 ' HB2' ' SD ' ' A' ' 16' ' ' MET . 2.9 m-20 -73.94 -31.3 62.99 Favored 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 174.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.407 ' SD ' ' HB2' ' A' ' 15' ' ' ASP . 0.9 OUTLIER -86.8 114.13 23.21 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.814 -175.285 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -102.45 -16.28 16.23 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.964 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -134.25 145.27 48.98 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.091 -174.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.524 ' SG ' HD13 ' A' ' 1' ' ' LEU . 33.7 m -92.74 140.81 29.14 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 168.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.54 ' CD2' ' HB2' ' A' ' 38' ' ' SER . 47.8 p90 -127.08 145.26 50.8 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.222 -1.391 . . . . 0.0 111.959 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -120.99 101.14 7.48 Favored 'General case' 0 C--N 1.274 -2.695 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 172.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.583 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 26.4 t-20 -104.48 138.05 41.44 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.4 t -162.4 -172.49 3.19 Favored 'General case' 0 N--CA 1.402 -2.869 0 N-CA-C 106.056 -1.831 . . . . 0.0 106.056 -177.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -139.08 -142.83 4.33 Favored Glycine 0 CA--C 1.481 -2.078 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -178.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.2 mtt -87.39 156.7 53.75 Favored Pre-proline 0 C--N 1.289 -2.047 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.09 106.39 1.71 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 121.709 1.606 . . . . 0.0 111.372 176.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.446 ' HB2' ' HB3' ' A' ' 30' ' ' LEU . 47.8 m-85 -107.43 138.24 43.99 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.3 mtp180 -60.04 123.81 18.27 Favored 'General case' 0 C--N 1.319 -0.731 0 O-C-N 123.124 0.265 . . . . 0.0 110.839 -177.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 69.75 4.99 4.99 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.757 1.223 . . . . 0.0 113.365 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . 63.8 tp -120.2 88.82 3.01 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-O 121.575 0.702 . . . . 0.0 109.976 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -87.55 87.63 7.45 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 177.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.629 HD23 ' H ' ' A' ' 32' ' ' LEU . 2.2 pt? -82.17 113.1 19.77 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 121.658 0.742 . . . . 0.0 110.385 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.7 mm -123.51 111.86 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.604 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.583 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 91.0 mt -124.64 67.98 1.09 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-O 121.878 0.847 . . . . 0.0 109.002 175.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -94.1 112.7 24.54 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.496 177.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.95 -158.15 7.52 Favored Glycine 0 C--N 1.283 -2.382 0 C-N-CA 120.104 -1.046 . . . . 0.0 110.927 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.7 m -123.87 134.34 53.59 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 175.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.54 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 45.7 t -112.37 144.59 41.56 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.263 0.554 . . . . 0.0 111.173 -173.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.8 m -86.46 -35.08 19.87 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 114.986 -1.007 . . . . 0.0 108.381 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 11.9 p -149.73 122.05 8.42 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.485 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.9 t -79.72 148.36 31.56 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -171.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.1 m -89.3 116.01 27.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 173.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -66.55 99.27 0.57 Allowed 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 122.241 1.019 . . . . 0.0 112.717 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.658 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 2.1 p -141.94 179.34 6.93 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.072 -179.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -94.95 -52.23 4.33 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.358 -178.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -76.76 -25.83 53.88 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.249 -173.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.658 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t30 -81.61 105.21 12.58 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 57.8 mtpt -88.3 120.32 29.55 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.736 -174.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.2 m -121.8 126.26 48.39 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -139.9 155.43 47.19 Favored 'General case' 0 C--N 1.284 -2.264 0 C-N-CA 121.28 -0.168 . . . . 0.0 110.71 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.8 p -104.75 32.91 3.84 Favored 'General case' 0 CA--C 1.558 1.254 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -173.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.2 p -130.47 147.26 52.14 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 121.733 -0.604 . . . . 0.0 111.421 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.437 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 75.2 m-20 -57.13 133.94 55.45 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.185 -177.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 78.6 mtm180 64.14 16.19 9.84 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 125.049 1.34 . . . . 0.0 114.031 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 25.6 p -75.96 -14.28 60.24 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.172 -0.611 . . . . 0.0 112.249 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -87.34 30.62 0.78 Allowed 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.641 -0.662 . . . . 0.0 111.454 -176.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.517 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 13.5 ptmm? . . . . . 0 C--O 1.254 1.319 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.521 HD13 ' SG ' ' A' ' 19' ' ' CYS . 19.1 mt . . . . . 0 CA--C 1.486 -1.484 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 36.2 pttt -109.93 110.43 21.38 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.183 172.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.511 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 72.9 m -136.9 164.34 28.56 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.984 -175.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.435 ' CE2' ' HB3' ' A' ' 54' ' ' ARG . 82.7 m-85 -84.4 81.58 8.77 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -176.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.502 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 8.1 tt0 -84.74 -42.94 14.75 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.223 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -106.17 19.07 21.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 -177.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.48 -38.59 3.15 Favored Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.45 153.8 24.28 Favored 'General case' 0 N--CA 1.426 -1.639 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.2 t -69.73 111.58 3.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 2' ' ' LYS . 13.0 m -111.31 152.04 13.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.7 m -89.12 117.38 28.07 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.4 m -74.35 156.38 37.15 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.117 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.681 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 11.9 t-80 -64.29 160.57 18.47 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.87 0.868 . . . . 0.0 110.695 -177.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.44 ' HE ' ' HB2' ' A' ' 14' ' ' ARG . 17.6 mtm180 -53.17 -40.47 64.38 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.451 1.1 . . . . 0.0 109.522 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -79.86 -8.52 59.34 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.571 -172.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.681 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.4 OUTLIER -92.37 101.38 13.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 121.717 0.77 . . . . 0.0 109.598 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -88.46 -19.49 26.42 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.17 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -135.05 155.46 50.71 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.521 ' SG ' HD13 ' A' ' 1' ' ' LEU . 86.3 m -113.47 145.78 40.63 Favored 'General case' 0 C--N 1.279 -2.486 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 171.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 49.1 p90 -124.61 150.59 45.81 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.421 -178.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 -127.24 111.94 14.53 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 177.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -102.27 105.85 16.56 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.515 ' O ' ' HA ' ' A' ' 46' ' ' ASN . 12.8 t -153.46 159.98 42.45 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.86 -51.73 0.7 Allowed Glycine 0 CA--C 1.467 -2.947 0 N-CA-C 108.099 -2.0 . . . . 0.0 108.099 -177.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 19.0 ptp -74.6 128.27 85.89 Favored Pre-proline 0 C--N 1.287 -2.149 0 CA-C-N 113.675 -1.262 . . . . 0.0 108.6 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -83.37 150.28 13.34 Favored 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 122.616 2.21 . . . . 0.0 111.783 -178.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -127.61 134.64 49.67 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.494 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -111.26 134.37 52.9 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.823 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 62.67 19.93 11.7 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.394 1.078 . . . . 0.0 111.562 -176.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.7 tp -168.33 149.35 4.93 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 tptt -128.5 87.84 2.65 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 173.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.0 tp -87.35 111.24 20.88 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.8 tp -122.67 99.29 6.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 CA-C-O 121.669 0.747 . . . . 0.0 109.625 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.1 mt -85.0 85.34 7.49 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.994 0.902 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.502 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 9.3 pt20 -116.59 107.73 15.08 Favored 'General case' 0 C--N 1.276 -2.602 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.393 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -144.22 -150.85 5.33 Favored Glycine 0 C--N 1.295 -1.7 0 C-N-CA 119.907 -1.14 . . . . 0.0 112.596 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.5 m -120.39 136.81 54.6 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.2 t -133.99 154.6 51.01 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 121.572 0.701 . . . . 0.0 111.229 -177.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.3 t -80.85 -20.99 41.12 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.491 177.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.1 p -127.64 170.21 12.92 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 120.763 0.316 . . . . 0.0 111.672 -177.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 45.3 t -127.03 104.01 7.77 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 m -97.2 96.47 8.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -78.89 103.98 9.21 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.051 -174.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.1 p -134.93 176.76 8.36 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -81.91 -28.82 32.64 Favored 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.0 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' A' ' 23' ' ' THR . 7.8 t30 -81.95 -47.24 12.95 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -103.11 106.45 16.97 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 94.6 mttt -101.57 120.17 39.9 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.919 -177.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.1 p -110.24 130.49 55.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-O 121.268 0.556 . . . . 0.0 111.49 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.0 p -139.42 156.5 46.93 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 124.062 0.945 . . . . 0.0 110.566 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.7 m -118.41 28.77 8.14 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.401 ' OG1' ' HB3' ' A' ' 55' ' ' CYS . 1.6 p -111.77 153.28 26.75 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 121.542 -0.724 . . . . 0.0 112.041 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.66 115.36 1.22 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.968 0.907 . . . . 0.0 112.372 176.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.435 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 61.7 mtm180 57.17 33.82 23.89 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 124.283 1.033 . . . . 0.0 112.672 176.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.401 ' HB3' ' OG1' ' A' ' 52' ' ' THR . 27.7 p -69.15 -23.21 63.93 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.491 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.511 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.5 p-10 -84.38 70.64 10.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 123.394 1.568 . . . . 0.0 110.0 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 59.5 pttt . . . . . 0 N--CA 1.418 -2.059 0 CA-C-N 113.332 -1.758 . . . . 0.0 108.966 -176.401 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 CA--C 1.486 -1.51 0 CA-C-O 121.269 0.557 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.633 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 18.6 pttm -109.66 118.26 36.09 Favored 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 172.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.581 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 92.1 m -132.6 164.57 26.38 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.431 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 77.4 m-85 -82.66 86.74 6.79 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.46 -174.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.626 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 9.8 tt0 -84.62 -42.09 15.73 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.062 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.421 ' C ' ' H ' ' A' ' 8' ' ' LYS . 30.2 m170 -106.6 20.18 19.39 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.544 -178.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.05 14.91 Favored Glycine 0 CA--C 1.502 -0.734 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 -173.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.421 ' H ' ' C ' ' A' ' 6' ' ' HIS . 35.4 mtmm -105.2 155.84 18.67 Favored 'General case' 0 N--CA 1.416 -2.153 0 C-N-CA 125.055 1.342 . . . . 0.0 108.331 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.2 t -73.16 118.38 18.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 123.75 0.656 . . . . 0.0 111.049 -176.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.7 m -114.22 151.14 16.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.1 m -90.91 101.97 14.73 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.4 m -74.09 141.45 45.66 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.94 163.68 19.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 -173.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -55.58 -20.64 14.14 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -178.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.491 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.4 m-20 -72.3 -25.16 61.47 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.653 0.74 . . . . 0.0 109.551 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.427 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -87.53 101.02 13.21 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.638 -175.241 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -98.39 -12.73 21.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.646 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.31 122.14 27.38 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -175.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 63.2 m -87.51 128.14 35.24 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 173.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.419 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 43.4 p90 -110.33 157.9 19.01 Favored 'General case' 0 C--N 1.296 -1.742 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.681 -172.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 19.4 t-160 -134.29 101.9 5.17 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.626 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -93.97 96.31 9.61 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.352 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.7 t -85.05 -15.72 43.08 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.608 -173.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.428 ' HA2' HD21 ' A' ' 46' ' ' ASN . . . 68.22 -146.37 45.92 Favored Glycine 0 N--CA 1.43 -1.729 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.946 178.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 67.0 mtt -83.48 147.8 53.69 Favored Pre-proline 0 C--N 1.291 -1.937 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 175.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.93 113.01 3.09 Favored 'Trans proline' 0 C--O 1.247 0.975 0 C-N-CA 122.268 1.979 . . . . 0.0 111.723 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.437 ' HB3' ' HB3' ' A' ' 30' ' ' LEU . 55.6 m-85 -104.18 144.07 32.08 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.111 176.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -86.59 129.43 34.87 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 69.52 -4.14 1.45 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 124.466 1.106 . . . . 0.0 112.178 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 27' ' ' PHE . 6.9 tt -120.72 124.27 44.74 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -100.72 105.27 16.6 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 176.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.9 tt -82.17 106.56 14.16 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 35.7 mm -115.24 98.8 7.35 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 CA-C-O 122.154 0.978 . . . . 0.0 112.478 -171.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.626 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 92.3 mt -111.79 66.85 0.64 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 170.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.626 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 27.9 mt-30 -99.94 115.0 28.65 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.135 178.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.17 -151.81 5.5 Favored Glycine 0 C--N 1.29 -1.977 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.225 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.435 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 74.3 m -131.3 135.01 46.93 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 178.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 t -130.48 149.27 52.23 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -177.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 17.7 m -66.53 -50.3 63.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -117.31 155.33 29.71 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 177.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 37.9 t -79.52 138.86 37.66 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.091 0.472 . . . . 0.0 111.675 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.8 t -87.54 115.4 24.94 Favored 'General case' 0 N--CA 1.423 -1.775 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 172.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -91.58 95.46 9.94 Favored 'General case' 0 C--N 1.285 -2.225 0 CA-C-O 122.085 0.945 . . . . 0.0 112.341 -173.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.437 HG23 ' H ' ' A' ' 47' ' ' ASN . 5.1 t -159.6 155.56 26.45 Favored 'General case' 0 N--CA 1.414 -2.235 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.03 -30.8 70.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.428 HD21 ' HA2' ' A' ' 24' ' ' GLY . 38.9 t-20 -60.62 -36.15 77.91 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.107 178.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.437 ' H ' HG23 ' A' ' 44' ' ' THR . 7.4 t30 -113.31 115.03 27.51 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-O 121.489 0.662 . . . . 0.0 111.712 -174.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -87.31 153.05 21.77 Favored 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.5 m -133.71 136.07 44.42 Favored 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.1 p -139.77 155.84 47.08 Favored 'General case' 0 C--N 1.285 -2.233 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -121.27 27.64 8.24 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -174.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.0 m -122.08 153.16 39.02 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.782 -0.574 . . . . 0.0 109.527 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.633 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 4.9 m-20 -63.04 129.13 39.01 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 63.87 27.57 14.5 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.483 1.113 . . . . 0.0 112.22 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 27.1 p -75.26 -23.77 57.51 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.7 p-10 -88.26 72.38 9.04 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 123.151 1.453 . . . . 0.0 110.201 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 51.5 pttt . . . . . 0 C--N 1.284 -2.28 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.198 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.472 HD22 ' SG ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.628 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -109.28 116.99 32.93 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 120.835 0.35 . . . . 0.0 110.962 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.472 ' SG ' HD22 ' A' ' 1' ' ' LEU . 87.1 m -140.97 165.77 26.62 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.656 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.616 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 66.3 m-85 -82.93 82.91 7.99 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.306 -174.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.426 ' HB3' HG21 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -84.68 -41.84 15.89 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.689 0.757 . . . . 0.0 110.075 177.023 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -103.35 19.46 19.64 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 122.394 1.092 . . . . 0.0 108.267 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.39 -27.4 11.99 Favored Glycine 0 C--O 1.219 -0.819 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 -178.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 12.7 mptt -105.16 162.53 13.31 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.0 t -69.72 106.92 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 O-C-N 123.816 0.697 . . . . 0.0 110.703 -179.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.426 HG21 ' HB3' ' A' ' 5' ' ' GLN . 30.8 m -117.53 152.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.4 m -87.9 112.64 22.75 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.331 0.586 . . . . 0.0 110.112 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.5 153.39 31.38 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -70.89 166.63 20.73 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.189 0.449 . . . . 0.0 110.954 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -65.88 -10.58 39.66 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -176.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.424 ' O ' ' HA ' ' A' ' 39' ' ' SER . 13.7 m-20 -77.05 -31.61 56.32 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 176.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.0 101.48 5.26 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.928 -174.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -94.11 -22.62 18.37 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.667 -178.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -126.2 147.02 49.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.346 -175.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -108.08 144.92 34.78 Favored 'General case' 0 C--N 1.272 -2.764 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 172.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 54.5 p90 -128.93 149.56 50.74 Favored 'General case' 0 N--CA 1.422 -1.848 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.807 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 19.1 t-160 -126.72 102.36 7.03 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 174.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.557 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 7.3 t30 -104.38 112.25 25.22 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.4 p -69.19 -26.68 64.95 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 124.272 0.982 . . . . 0.0 113.004 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.37 -160.43 41.97 Favored Glycine 0 N--CA 1.428 -1.884 0 N-CA-C 109.921 -1.271 . . . . 0.0 109.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 99.1 mmm -98.79 138.36 20.68 Favored Pre-proline 0 C--N 1.288 -2.081 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.37 117.89 4.89 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.903 2.402 . . . . 0.0 113.28 -176.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -131.65 143.69 50.49 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -71.79 125.53 27.4 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 72.62 -3.29 2.39 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.22 1.408 . . . . 0.0 112.736 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -118.61 94.37 4.44 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-O 121.153 0.501 . . . . 0.0 110.672 -178.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -93.59 107.75 19.57 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 tp -77.03 105.52 8.16 Favored 'General case' 0 N--CA 1.424 -1.726 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 33' ' ' ILE . 30.6 mm -86.85 97.52 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 121.791 0.805 . . . . 0.0 110.938 -176.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.557 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 75.6 mt -111.53 63.99 0.62 Allowed 'General case' 0 N--CA 1.415 -2.181 0 CA-C-O 122.388 1.089 . . . . 0.0 108.872 172.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.1 112.64 25.38 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 113.884 -1.507 . . . . 0.0 107.505 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.8 -163.36 10.21 Favored Glycine 0 C--N 1.282 -2.425 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.983 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.6 m -125.83 142.44 51.51 Favored 'General case' 0 C--N 1.286 -2.154 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.0 t -133.93 154.31 51.17 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-O 121.191 0.519 . . . . 0.0 110.261 -177.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 5.5 m -71.02 -45.45 63.91 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.833 178.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.2 t -119.35 -171.36 2.1 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.3 t -128.52 134.87 48.78 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.3 m -90.27 101.08 13.8 Favored 'General case' 0 N--CA 1.426 -1.645 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 170.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.23 114.67 12.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.654 0.74 . . . . 0.0 112.949 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.595 HG23 ' H ' ' A' ' 47' ' ' ASN . 2.3 t -164.93 169.59 16.29 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 114.385 -1.28 . . . . 0.0 107.937 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -86.76 -24.85 24.95 Favored 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -75.35 -47.81 25.93 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.595 ' H ' HG23 ' A' ' 44' ' ' THR . 6.8 t30 -98.16 98.93 10.15 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.795 176.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.493 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 62.4 mttp -86.1 119.63 26.6 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.776 -177.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 56.8 m -102.84 131.74 49.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 21.3 p -139.46 156.07 47.18 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 3.3 p -126.89 33.44 4.94 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 13.4 m -119.5 157.78 27.61 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.1 124.58 22.0 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.682 0.277 . . . . 0.0 111.449 -176.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.7 mtm180 63.21 26.44 15.2 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 124.413 1.085 . . . . 0.0 111.756 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.7 p -72.76 -22.13 60.9 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 -175.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -87.6 32.39 0.72 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 121.956 0.884 . . . . 0.0 111.716 -174.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.616 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 N--CA 1.432 -1.338 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.352 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.47 HD13 ' SG ' ' A' ' 19' ' ' CYS . 25.1 mt . . . . . 0 CA--C 1.49 -1.34 0 CA-C-O 120.848 0.356 . . . . 0.0 111.668 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.441 ' HG2' ' OD2' ' A' ' 53' ' ' ASP . 23.5 pttm -109.16 107.57 17.9 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 173.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.608 ' HB3' ' OD1' ' A' ' 56' ' ' ASN . 76.5 m -135.25 165.94 24.27 Favored 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 -173.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 90.0 m-85 -79.66 74.01 6.35 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.491 0.662 . . . . 0.0 109.563 -177.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.493 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 7.4 tt0 -84.59 -39.47 18.68 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.332 -177.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -106.08 19.67 20.16 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.755 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.86 -34.41 4.93 Favored Glycine 0 C--N 1.312 -0.777 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 38.2 mtmm -105.28 162.97 12.96 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.436 -0.882 . . . . 0.0 109.993 175.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.6 t -68.15 111.29 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 O-C-N 124.145 0.903 . . . . 0.0 108.791 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.493 ' CG2' ' HB3' ' A' ' 5' ' ' GLN . 34.1 m -130.85 152.27 37.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 97.8 m -76.9 112.63 13.71 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 121.383 0.611 . . . . 0.0 109.733 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.4 m -80.36 151.06 29.63 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.17 -0.923 . . . . 0.0 108.816 178.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.426 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 4.0 t-80 -61.95 162.43 9.13 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 122.924 0.49 . . . . 0.0 110.458 -174.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -69.27 -16.03 63.49 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -77.36 -23.67 50.8 Favored 'General case' 0 CA--C 1.496 -1.125 0 CA-C-O 121.531 0.681 . . . . 0.0 109.343 176.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.426 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.9 OUTLIER -78.45 101.37 7.27 Favored 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.513 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.2 tttp -90.11 -23.03 21.5 Favored 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.573 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -130.96 146.6 52.41 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.991 -172.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.47 ' SG ' HD13 ' A' ' 1' ' ' LEU . 32.0 m -110.67 130.63 55.52 Favored 'General case' 0 C--N 1.28 -2.427 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 172.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.4 p90 -119.45 162.08 19.45 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.767 -1.173 . . . . 0.0 113.587 -173.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -128.12 105.9 8.69 Favored 'General case' 0 N--CA 1.416 -2.17 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 169.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 34' ' ' LEU . 16.4 t-20 -97.75 123.18 41.58 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -178.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.8 p -91.35 120.83 32.55 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 120.989 0.424 . . . . 0.0 111.834 -175.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.96 -174.86 36.43 Favored Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 174.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 73.9 mtm -72.69 148.16 89.79 Favored Pre-proline 0 C--N 1.308 -1.197 0 CA-C-N 117.87 0.835 . . . . 0.0 109.609 177.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.24 110.31 1.97 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.183 1.922 . . . . 0.0 112.222 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.06 139.01 46.78 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -92.4 146.18 23.89 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 175.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.7 m120 66.85 7.42 5.27 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.154 0.982 . . . . 0.0 110.993 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.0 tp -147.9 88.47 1.68 Allowed 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -89.34 82.84 6.43 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.939 0.876 . . . . 0.0 109.968 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 pp -76.65 106.05 8.07 Favored 'General case' 0 N--CA 1.419 -2.005 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.3 tp -99.06 127.51 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.966 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.57 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 22' ' ' ASN . 80.3 mt -116.35 84.84 2.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -128.22 115.44 18.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.501 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.427 ' HA2' ' HA ' ' A' ' 5' ' ' GLN . . . -144.33 -177.97 19.64 Favored Glycine 0 N--CA 1.411 -2.978 0 N-CA-C 109.851 -1.299 . . . . 0.0 109.851 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.473 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 88.8 m -113.21 136.23 52.95 Favored 'General case' 0 C--N 1.275 -2.649 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.7 t -131.86 155.57 47.6 Favored 'General case' 0 C--N 1.293 -1.855 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.896 -174.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -84.16 -46.66 11.66 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 m -107.02 158.8 16.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 176.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 39.7 t -150.72 149.0 29.24 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 120.685 0.279 . . . . 0.0 110.887 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.4 m -119.8 92.46 3.79 Favored 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 170.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.07 110.07 1.7 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.457 0.646 . . . . 0.0 111.04 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -139.19 -172.11 3.26 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-N 114.92 -1.037 . . . . 0.0 108.335 -177.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.16 -34.28 56.42 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 174.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -65.92 -57.91 6.78 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.129 -1.396 . . . . 0.0 109.995 178.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -110.56 109.79 20.25 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.179 0.514 . . . . 0.0 110.26 -177.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -101.88 121.96 43.1 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.613 -178.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 85.4 m -114.04 145.27 41.82 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-O 120.959 0.409 . . . . 0.0 111.493 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.9 p -139.67 154.81 47.6 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.6 m -128.47 70.31 1.37 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.699 0.761 . . . . 0.0 109.999 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.454 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 9.3 m -148.87 154.78 39.95 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.441 ' OD2' ' HG2' ' A' ' 2' ' ' LYS . 8.1 m-20 -63.91 126.08 26.49 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 -177.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 61.27 26.4 16.24 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 124.461 1.104 . . . . 0.0 112.595 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.454 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 30.1 p -71.64 -28.47 63.79 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 119.896 -0.721 . . . . 0.0 111.725 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.608 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 35.0 p-10 -90.85 69.44 6.45 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 122.704 1.24 . . . . 0.0 111.08 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.464 ' HB3' ' CE1' ' A' ' 4' ' ' PHE . 21.4 ptmt . . . . . 0 C--N 1.293 -1.884 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.095 179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.41 ' HA ' ' OD1' ' A' ' 53' ' ' ASP . 28.9 mt . . . . . 0 CA--C 1.486 -1.507 0 CA-C-O 120.944 0.402 . . . . 0.0 111.514 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -110.63 113.3 25.8 Favored 'General case' 0 N--CA 1.414 -2.262 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.856 169.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 m -124.84 163.82 21.36 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 -174.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.632 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 88.7 m-85 -80.12 94.0 5.91 Favored 'General case' 0 C--O 1.195 -1.791 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.492 ' HA ' ' O ' ' A' ' 35' ' ' GLN . 9.2 tt0 -84.68 -38.86 19.27 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.366 -0.934 . . . . 0.0 110.901 176.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -106.59 7.8 30.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.871 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.95 -17.6 58.49 Favored Glycine 0 C--N 1.311 -0.839 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 -170.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -104.77 154.79 19.56 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 43.9 t -75.42 124.86 34.21 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 O-C-N 123.785 0.678 . . . . 0.0 110.04 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.9 m -130.37 152.37 37.36 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.9 m -79.31 119.27 22.12 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.6 m -76.97 163.38 26.77 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.342 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.57 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 7.4 t-80 -71.5 165.26 24.23 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.442 ' HA ' ' NE ' ' A' ' 14' ' ' ARG . 3.1 mmp_? -60.9 -21.53 63.44 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.385 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.85 -15.52 41.6 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 120.751 0.31 . . . . 0.0 111.042 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.57 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.7 OUTLIER -76.79 103.5 6.78 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.664 0.745 . . . . 0.0 112.91 -173.198 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -88.15 -22.62 23.97 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.153 -178.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -134.77 151.88 51.31 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.937 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.8 m -96.99 129.46 44.45 Favored 'General case' 0 C--N 1.283 -2.317 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 169.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.427 ' CD2' ' HB2' ' A' ' 38' ' ' SER . 42.8 p90 -108.52 147.71 31.33 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 118.908 -1.117 . . . . 0.0 110.387 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.544 ' CD2' ' HG2' ' A' ' 35' ' ' GLN . 21.1 t-160 -131.2 102.18 5.88 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 175.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.546 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -97.93 103.55 15.5 Favored 'General case' 0 C--N 1.29 -1.98 0 N-CA-C 106.382 -1.711 . . . . 0.0 106.382 179.175 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.0 p -77.99 170.18 17.03 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 114.394 -1.275 . . . . 0.0 112.271 -173.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -153.99 171.68 32.64 Favored Glycine 0 N--CA 1.418 -2.518 0 N-CA-C 108.969 -1.652 . . . . 0.0 108.969 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 89.8 mtp -84.3 149.18 54.7 Favored Pre-proline 0 C--N 1.297 -1.68 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.17 112.45 3.43 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 121.951 1.767 . . . . 0.0 111.304 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -114.95 146.39 41.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -45.36 107.59 0.1 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.466 0.707 . . . . 0.0 111.659 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 68.3 17.9 9.22 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.768 1.227 . . . . 0.0 112.181 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.9 tp -141.08 93.33 2.58 Favored 'General case' 0 N--CA 1.428 -1.568 0 CA-C-O 121.806 0.812 . . . . 0.0 111.909 -179.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -96.66 109.8 22.36 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 103.374 -2.825 . . . . 0.0 103.374 170.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.34 106.38 6.84 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 121.65 0.738 . . . . 0.0 109.737 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.42 ' HA ' HD13 ' A' ' 33' ' ' ILE . 18.4 mm -108.84 106.28 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.801 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.188 -176.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 97.5 mt -123.89 65.98 1.04 Allowed 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.891 174.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.544 ' HG2' ' CD2' ' A' ' 21' ' ' HIS . 52.2 mt-30 -102.61 116.99 33.71 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.56 -164.94 11.05 Favored Glycine 0 C--N 1.286 -2.204 0 C-N-CA 118.802 -1.666 . . . . 0.0 112.76 -178.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 24.5 m -117.73 135.39 54.06 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 177.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.427 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 47.4 t -133.98 152.73 51.96 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.336 -177.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 t -83.99 -34.13 24.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 43.6 p -115.35 -174.89 2.59 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 14.1 t -135.98 130.06 33.05 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.116 0.484 . . . . 0.0 111.885 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.2 m -91.87 104.43 16.86 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 172.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.16 102.33 5.72 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.462 -176.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.2 p -144.79 176.79 9.18 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -92.28 -17.53 24.63 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.873 0.844 . . . . 0.0 110.271 175.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -77.01 -37.85 54.21 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.192 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -113.2 108.28 17.06 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.379 0.609 . . . . 0.0 110.62 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -88.96 153.36 21.09 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.585 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.8 p -146.21 124.07 11.98 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.6 p -139.46 155.6 47.47 Favored 'General case' 0 C--N 1.278 -2.534 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 68.4 m -107.16 28.26 8.23 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -174.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 55' ' ' CYS . 2.8 m -108.69 147.48 31.86 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.41 ' OD1' ' HA ' ' A' ' 1' ' ' LEU . 15.5 m-20 -65.9 124.4 22.4 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.434 -178.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 66.16 28.34 10.17 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.479 1.112 . . . . 0.0 112.691 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.478 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 29.2 p -89.25 -9.07 52.04 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.624 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -85.21 37.63 0.68 Allowed 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.677 -0.639 . . . . 0.0 111.373 -176.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.632 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.5 pttm . . . . . 0 C--N 1.307 -1.257 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.758 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.646 HD13 ' SG ' ' A' ' 19' ' ' CYS . 17.0 mt . . . . . 0 CA--C 1.479 -1.775 0 N-CA-C 111.308 0.114 . . . . 0.0 111.308 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -109.3 101.83 10.8 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.481 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 70.9 m -133.39 164.52 26.94 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.054 0.454 . . . . 0.0 111.516 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.8 m-85 -82.31 83.43 7.44 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.0 -176.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -84.82 -41.84 15.69 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 119.508 -0.877 . . . . 0.0 110.403 177.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -106.38 19.3 20.72 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.532 0.682 . . . . 0.0 110.644 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.97 -35.46 4.54 Favored Glycine 0 C--N 1.305 -1.155 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -97.95 162.86 13.03 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 31.9 t -72.1 113.74 9.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 O-C-N 123.985 0.803 . . . . 0.0 109.473 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.12 151.88 34.49 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 34.4 m -79.86 121.62 25.64 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.17 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.3 m -86.33 136.95 32.95 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -62.13 165.02 6.11 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.921 0.763 . . . . 0.0 111.798 -170.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -64.44 -11.7 36.02 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.412 ' O ' ' HA ' ' A' ' 39' ' ' SER . 5.7 m-20 -78.92 -22.07 46.37 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -96.05 102.93 14.79 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.317 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -94.92 -16.62 22.7 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.248 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -130.61 130.81 44.47 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.607 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.646 ' SG ' HD13 ' A' ' 1' ' ' LEU . 45.2 m -95.84 143.89 26.66 Favored 'General case' 0 C--N 1.283 -2.298 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 174.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.528 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 48.4 p90 -126.77 153.1 46.01 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.986 -177.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -136.15 114.48 11.64 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.679 -1.146 . . . . 0.0 108.809 176.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.423 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 0.2 OUTLIER -76.45 112.84 13.4 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 175.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.7 t -151.75 -168.25 3.02 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 145.75 -94.96 0.17 Allowed Glycine 0 N--CA 1.427 -1.951 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.0 mtm -97.44 153.87 38.21 Favored Pre-proline 0 C--N 1.276 -2.6 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -60.53 126.96 21.26 Favored 'Trans proline' 0 C--O 1.254 1.298 0 C-N-CA 121.668 1.578 . . . . 0.0 110.672 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -73.88 130.09 39.2 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.651 -177.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -129.57 119.55 23.82 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m120 70.95 17.26 6.32 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.385 1.074 . . . . 0.0 110.371 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 tp -140.26 80.78 1.78 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -85.71 66.57 9.71 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-O 122.164 0.983 . . . . 0.0 111.044 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.75 122.77 39.52 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.361 -1.291 . . . . 0.0 108.851 174.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.6 tp -119.21 105.95 18.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.287 0 CA-C-O 121.792 0.806 . . . . 0.0 108.992 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB2' ' CB ' ' A' ' 22' ' ' ASN . 6.2 mp -94.97 91.91 6.61 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.962 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -119.26 112.01 18.93 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 176.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.42 -160.51 8.64 Favored Glycine 0 C--N 1.29 -2.021 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.92 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.481 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 76.4 m -138.26 137.25 37.31 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.9 t -133.96 155.37 50.06 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.097 0.475 . . . . 0.0 111.435 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 21.5 m -70.76 -39.03 73.47 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.426 -0.807 . . . . 0.0 110.085 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -131.9 132.65 43.8 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 20' ' ' TYR . 11.2 t -134.3 148.39 50.76 Favored 'General case' 0 C--N 1.294 -1.805 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.201 -173.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.9 m -98.68 100.17 11.36 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.12 110.84 1.97 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.062 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.9 p -148.21 176.65 10.06 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 -177.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -78.8 -29.27 44.8 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -71.32 -53.1 15.37 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.779 -1.1 . . . . 0.0 109.543 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -114.38 101.39 9.11 Favored 'General case' 0 N--CA 1.415 -2.182 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 60.3 tttm -82.86 108.02 15.9 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.673 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 34.0 m -100.13 128.12 46.26 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 p -140.19 156.15 46.63 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.637 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.2 p -115.96 34.99 4.67 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -174.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.1 m -136.59 156.3 48.75 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.055 -1.028 . . . . 0.0 111.237 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -48.31 122.62 5.5 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 124.904 1.282 . . . . 0.0 112.073 177.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 56.66 31.29 18.98 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.946 1.298 . . . . 0.0 113.409 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 31.9 p -77.25 -20.29 55.39 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.233 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.447 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 31.7 p-10 -89.91 67.06 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 122.925 1.345 . . . . 0.0 111.392 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.485 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 24.6 pttm . . . . . 0 N--CA 1.423 -1.8 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.57 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.404 HD13 ' SG ' ' A' ' 19' ' ' CYS . 31.0 mt . . . . . 0 CA--C 1.488 -1.43 0 CA-C-O 121.176 0.512 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HG2' ' OD1' ' A' ' 53' ' ' ASP . 22.7 pttm -109.55 113.59 26.51 Favored 'General case' 0 N--CA 1.415 -2.18 0 CA-C-N 115.436 -0.802 . . . . 0.0 108.965 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.583 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 92.7 m -136.17 165.49 25.62 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.723 -174.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.551 ' CE2' ' HB3' ' A' ' 57' ' ' LYS . 75.6 m-85 -79.72 86.85 5.27 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.226 -174.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -85.09 -41.55 15.63 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.652 0.739 . . . . 0.0 111.389 177.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -106.49 -0.31 24.11 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.723 0.773 . . . . 0.0 111.052 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 121.68 -37.45 2.92 Favored Glycine 0 N--CA 1.43 -1.755 0 N-CA-C 108.74 -1.744 . . . . 0.0 108.74 -175.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 19.1 ptpt -94.96 161.97 13.93 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.433 HG12 ' HB2' ' A' ' 2' ' ' LYS . 16.5 t -75.85 122.2 29.33 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.202 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.6 m -130.41 151.57 36.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.142 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 98.0 m -72.11 118.86 15.51 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.75 158.61 22.78 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.694 ' HB3' ' SD ' ' A' ' 16' ' ' MET . 12.5 t-80 -61.07 159.63 11.41 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.55 0.74 . . . . 0.0 111.977 -173.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -51.77 -32.37 30.74 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.282 1.433 . . . . 0.0 111.984 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 39' ' ' SER . 10.1 m-20 -86.34 -14.17 44.34 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.163 0.506 . . . . 0.0 110.815 -174.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.694 ' SD ' ' HB3' ' A' ' 13' ' ' HIS . 0.5 OUTLIER -83.1 100.41 10.5 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.093 -176.31 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -97.55 -14.85 20.8 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.029 -177.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -131.36 147.85 52.61 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.485 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 57.4 m -107.38 145.97 32.23 Favored 'General case' 0 C--N 1.267 -2.981 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 174.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.446 ' HA ' ' O ' ' A' ' 48' ' ' LYS . 47.7 p90 -130.83 147.48 52.49 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.715 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.2 t-160 -119.5 101.71 8.13 Favored 'General case' 0 C--N 1.273 -2.737 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 172.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.616 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 23.7 t-20 -105.67 135.03 47.83 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.0 t -141.53 175.78 9.41 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -176.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.48 -157.96 20.5 Favored Glycine 0 CA--C 1.498 -1.007 0 C-N-CA 120.121 -1.038 . . . . 0.0 111.996 -176.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 66.9 mtm -75.55 128.81 83.26 Favored Pre-proline 0 C--N 1.313 -1.021 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -67.31 104.89 0.95 Allowed 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 121.926 1.751 . . . . 0.0 113.46 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -132.52 145.62 51.3 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 125.728 1.611 . . . . 0.0 106.993 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -55.2 116.9 3.06 Favored 'General case' 0 C--O 1.245 0.857 0 O-C-N 123.41 0.444 . . . . 0.0 110.826 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 81.33 -3.38 1.68 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.233 1.413 . . . . 0.0 113.592 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -87.93 84.72 6.96 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.8 pttt -106.38 87.61 2.59 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.476 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.7 tp -83.98 106.06 15.35 Favored 'General case' 0 N--CA 1.417 -2.11 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.8 mm -104.28 100.7 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.947 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.688 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 90.1 mt -120.7 63.8 0.85 Allowed 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.37 -1.287 . . . . 0.0 107.537 174.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -91.6 114.84 27.48 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 177.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.94 -160.96 8.94 Favored Glycine 0 C--N 1.291 -1.956 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.686 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.583 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 78.2 m -128.4 145.34 51.12 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 173.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -133.89 162.13 32.87 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 16.2 t -82.0 -22.67 36.41 Favored 'General case' 0 N--CA 1.417 -2.108 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.164 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.8 p -133.01 176.41 8.52 Favored 'General case' 0 N--CA 1.424 -1.739 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 10.8 t -112.53 115.54 28.8 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.466 178.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.5 m -77.89 97.08 5.16 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 172.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.65 86.92 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 124.555 1.142 . . . . 0.0 114.067 -172.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.471 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 30.5 p -147.99 163.59 36.4 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 176.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -90.44 -17.18 27.62 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.284 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -72.52 -44.23 62.47 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.815 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.488 ' HB2' HD22 ' A' ' 22' ' ' ASN . 7.8 t30 -98.97 95.55 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 174.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 20' ' ' TYR . 66.7 mttm -80.87 110.61 16.57 Favored 'General case' 0 C--N 1.279 -2.466 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.3 -175.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.7 p -99.79 133.6 43.91 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 22.2 p -140.27 156.36 46.5 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.6 p -132.21 68.03 1.51 Allowed 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 121.346 0.594 . . . . 0.0 111.583 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -149.02 156.71 42.65 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 176.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.437 ' OD1' ' HG2' ' A' ' 2' ' ' LYS . 12.2 m-20 -61.99 127.86 33.38 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 73.6 mtt180 61.71 26.12 15.84 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.885 0.874 . . . . 0.0 113.064 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 19' ' ' CYS . 28.2 p -72.02 -28.79 63.6 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.528 ' OD1' ' HB3' ' A' ' 3' ' ' CYS . 34.2 p-10 -86.82 66.28 9.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.537 1.16 . . . . 0.0 111.403 -176.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.551 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 23.5 pttm . . . . . 0 C--N 1.296 -1.721 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.313 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 C--O 1.207 -1.147 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.4 ' HE3' ' OD1' ' A' ' 53' ' ' ASP . 48.9 pttt -109.27 119.64 40.11 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.547 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 93.2 m -140.93 164.59 29.86 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.53 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.604 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 86.6 m-85 -80.64 89.2 5.7 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.62 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.532 ' HG2' ' HA2' ' A' ' 36' ' ' GLY . 25.6 mt-30 -80.31 -43.1 21.81 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.021 -1.072 . . . . 0.0 112.164 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -106.95 14.47 26.46 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.756 0.789 . . . . 0.0 109.371 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.73 -9.67 70.89 Favored Glycine 0 N--CA 1.44 -1.066 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -173.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.604 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 67.1 mttm -105.84 152.4 23.29 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 176.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.5 t -76.65 106.45 6.58 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -119.19 152.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-O 120.654 0.264 . . . . 0.0 111.022 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.9 m -79.43 106.03 11.17 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-O 121.274 0.559 . . . . 0.0 110.773 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 m -86.34 133.96 33.76 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 173.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -70.26 174.56 5.45 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.129 0.268 . . . . 0.0 110.652 -173.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 57.9 mtm180 -75.75 -3.87 37.3 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.234 0.54 . . . . 0.0 111.719 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -76.03 -29.8 58.22 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -86.04 101.02 12.56 Favored 'General case' 0 N--CA 1.421 -1.914 0 CA-C-N 114.246 -1.343 . . . . 0.0 109.27 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -91.41 -17.31 25.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.723 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -135.14 130.37 35.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.151 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 60.0 m -94.32 145.18 24.93 Favored 'General case' 0 C--N 1.277 -2.574 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 172.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -127.86 155.98 43.29 Favored 'General case' 0 C--N 1.282 -2.34 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.999 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.406 ' CD2' HD11 ' A' ' 33' ' ' ILE . 12.9 t-80 -138.44 102.32 4.59 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 177.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.497 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 27.9 t-20 -107.72 95.83 5.97 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 177.478 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 t -88.5 136.6 32.91 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.372 -171.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.76 135.96 23.85 Favored Glycine 0 N--CA 1.428 -1.867 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.774 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -62.65 155.7 68.09 Favored Pre-proline 0 C--N 1.315 -0.922 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.01 107.65 0.33 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 122.942 2.428 . . . . 0.0 113.322 179.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -132.33 143.69 50.04 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 174.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -71.24 115.65 10.64 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.406 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 71.98 -3.61 2.18 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.17 1.388 . . . . 0.0 113.499 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 36.1 tp -118.26 120.58 38.1 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.224 -0.591 . . . . 0.0 110.359 -177.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.34 89.19 2.48 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.022 0.915 . . . . 0.0 109.202 174.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.523 HD23 ' H ' ' A' ' 32' ' ' LEU . 2.0 pt? -76.35 106.11 7.79 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.426 HD12 ' O ' ' A' ' 22' ' ' ASN . 6.4 tp -121.05 118.89 57.7 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.114 -171.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.497 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 83.0 mt -115.42 98.43 6.73 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 177.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 3.8 pt20 -130.91 104.36 7.09 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-O 121.26 0.553 . . . . 0.0 110.223 -179.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.532 ' HA2' ' HG2' ' A' ' 5' ' ' GLN . . . -145.17 -144.46 4.14 Favored Glycine 0 N--CA 1.419 -2.48 0 C-N-CA 119.932 -1.127 . . . . 0.0 112.253 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 83.0 m -132.01 133.39 44.39 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.1 t -131.0 163.74 26.91 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-O 121.337 0.589 . . . . 0.0 109.643 -178.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.0 t -82.29 -15.16 53.93 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.366 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.2 m -141.16 164.53 30.0 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.0 t -97.43 129.29 44.66 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -78.45 105.67 9.87 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -78.53 114.23 17.25 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.717 -177.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.444 HG23 ' H ' ' A' ' 47' ' ' ASN . 11.3 t -173.22 -174.61 1.06 Allowed 'General case' 0 C--N 1.285 -2.2 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.71 -42.55 13.28 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 118.46 0.573 . . . . 0.0 111.96 -175.14 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -79.5 -27.07 41.45 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -173.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.444 ' H ' HG23 ' A' ' 44' ' ' THR . 7.7 t30 -90.63 107.35 19.11 Favored 'General case' 0 CA--C 1.491 -1.314 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.361 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -91.43 145.04 24.96 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.3 p -132.39 136.2 46.64 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.47 0.653 . . . . 0.0 111.115 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.2 p -140.09 157.35 45.77 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 115.362 -0.835 . . . . 0.0 108.92 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 m -124.88 45.14 2.61 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.8 t -148.03 165.42 30.82 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.868 179.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.4 ' OD1' ' HE3' ' A' ' 2' ' ' LYS . 1.0 OUTLIER -52.4 121.25 6.64 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 114.705 -1.134 . . . . 0.0 113.149 -176.804 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 45.9 mtm180 60.58 22.24 12.02 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 124.902 1.281 . . . . 0.0 113.579 175.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.9 p -71.21 -25.71 62.63 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -175.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -87.97 29.17 0.95 Allowed 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 121.113 0.482 . . . . 0.0 111.609 -174.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.565 ' HB3' ' CE2' ' A' ' 4' ' ' PHE . 21.8 pttp . . . . . 0 C--O 1.254 1.331 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.238 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 24.6 mt . . . . . 0 CA--C 1.486 -1.516 0 CA-C-O 120.861 0.362 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -109.66 115.27 29.56 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.199 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.513 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 94.2 m -139.78 165.17 28.0 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 120.948 0.404 . . . . 0.0 111.887 -174.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.527 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 88.9 m-85 -75.33 87.11 2.53 Favored 'General case' 0 C--O 1.208 -1.083 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.347 -176.294 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.471 HE21 HG21 ' A' ' 10' ' ' VAL . 8.5 tt0 -84.97 -41.73 15.59 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.825 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -102.41 -4.48 25.42 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.232 1.015 . . . . 0.0 109.215 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 122.2 -23.86 7.14 Favored Glycine 0 N--CA 1.429 -1.8 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -175.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 4' ' ' PHE . 65.3 pttt -102.05 161.2 13.86 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.32 117.34 23.51 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.471 HG21 HE21 ' A' ' 5' ' ' GLN . 18.7 m -123.48 152.43 28.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 178.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.8 m -77.89 111.8 14.1 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.59 152.61 28.48 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -74.96 166.66 23.31 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 110.659 -0.126 . . . . 0.0 110.659 -173.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -53.02 -27.71 20.79 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.965 1.306 . . . . 0.0 112.623 -178.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.552 ' O ' ' HA ' ' A' ' 39' ' ' SER . 6.6 m-20 -69.4 -31.14 69.32 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.473 ' HB3' ' HB3' ' A' ' 37' ' ' CYS . 0.1 OUTLIER -86.93 101.01 13.0 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.364 -175.209 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -110.94 -3.61 15.53 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.488 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -134.89 124.41 24.95 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 37' ' ' CYS . 67.1 m -93.6 140.68 29.34 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.055 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.5 p90 -121.57 147.94 45.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 121.412 0.625 . . . . 0.0 111.71 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.419 ' HB2' ' HB2' ' A' ' 56' ' ' ASN . 20.2 t-160 -135.66 101.44 4.78 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.576 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 19.5 t-20 -83.54 125.91 32.26 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 175.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 53.3 p -71.69 -13.8 61.84 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 123.744 0.652 . . . . 0.0 111.803 -174.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 81.4 -173.36 54.14 Favored Glycine 0 N--CA 1.423 -2.214 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.754 179.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 92.4 mtp -133.87 108.03 11.71 Favored Pre-proline 0 C--N 1.292 -1.909 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.89 108.48 1.92 Allowed 'Trans proline' 0 C--O 1.249 1.06 0 C-N-CA 122.577 2.185 . . . . 0.0 114.679 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -131.82 143.93 50.55 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 174.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -52.46 120.81 6.01 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.413 0.446 . . . . 0.0 112.133 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.0 m120 70.32 10.08 7.17 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.268 1.427 . . . . 0.0 112.931 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -113.75 88.31 2.82 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 175.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -85.82 83.48 7.82 Favored 'General case' 0 N--CA 1.427 -1.599 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.9 tp -83.35 105.36 14.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.414 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.459 HD13 ' HA ' ' A' ' 33' ' ' ILE . 5.1 mm -125.23 121.13 59.95 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.014 178.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.576 ' HB2' ' HB3' ' A' ' 22' ' ' ASN . 48.6 mt -127.51 78.0 1.79 Allowed 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -102.17 109.11 20.72 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -145.83 -158.76 7.85 Favored Glycine 0 C--N 1.292 -1.91 0 C-N-CA 119.895 -1.145 . . . . 0.0 112.539 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 3' ' ' CYS . 91.3 m -132.07 139.64 48.59 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 176.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 t -132.25 161.02 34.49 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 120.874 0.369 . . . . 0.0 110.09 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.552 ' HA ' ' O ' ' A' ' 15' ' ' ASP . 23.0 t -76.2 -33.81 59.27 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 t -137.29 151.12 48.33 Favored 'General case' 0 N--CA 1.417 -2.096 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 9.6 t -70.45 119.86 15.24 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 177.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.9 m -80.88 87.87 5.9 Favored 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.87 100.67 0.06 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.02 -172.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.508 ' OG1' ' HB3' ' A' ' 47' ' ' ASN . 3.7 p -142.53 159.48 42.16 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.693 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -84.23 -27.5 27.92 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -88.18 -0.49 57.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.552 0.691 . . . . 0.0 110.613 -177.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.508 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.1 t30 -125.0 130.26 51.99 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.272 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -96.14 126.86 41.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.8 p -120.44 129.21 53.79 Favored 'General case' 0 C--N 1.283 -2.321 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 2.4 p -140.23 156.13 46.62 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.638 -177.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.3 p -110.09 27.31 9.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.6 m -119.98 150.54 40.36 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.56 136.25 55.36 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.501 -0.479 . . . . 0.0 109.986 -175.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 63.88 15.86 9.43 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.494 1.117 . . . . 0.0 113.007 177.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.401 ' C ' ' H ' ' A' ' 57' ' ' LYS . 30.1 p -73.28 -12.57 60.89 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.961 0.41 . . . . 0.0 111.749 -177.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.419 ' HB2' ' HB2' ' A' ' 21' ' ' HIS . 28.9 p-10 -92.48 29.78 1.64 Allowed 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.819 1.295 . . . . 0.0 109.023 -174.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.439 ' HG2' ' CE2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.415 -2.204 0 C-N-CA 127.924 2.489 . . . . 0.0 109.332 -177.988 . . . . . . . . 2 2 . 1 stop_ save_